Vitas-M small molecule compound

(1'R,2'R)-1'-[(3-methoxyphenyl)carbonyl]-2'-(4-nitrophenyl)-1',2'-dihydro-3a'H-spiro[indene-2,3'-pyrrolo[1,2-a]quinoline]-1,3-dione

Catalog ID
STL055221
SMILES COc1cccc(c1)C(=O)[C@@H]1N2c3ccccc3C=CC2[C@@]2([C@H]1c1ccc(cc1)[N+](=O)[O-])C(=O)c1c(C2=O)cccc1

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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.

We do not supply quantities above 5 g.

Structure and other identifiers

2D representation rendered from the SMILES, with core physicochemical data.
Formula C34H24N2O6 MW 556.57 g/mol Purity >90% as per NMR
InChI
InChI=1S/C34H24N2O6/c1-42-24-9-6-8-22(19-24)31(37)30-29(21-13-16-23(17-14-21)36(40)41)34(32(38)25-10-3-4-11-26(25)33(34)39)28-18-15-20-7-2-5-12-27(20)35(28)30/h2-19,28-30H,1H3/t28?,29-,30+/m0/s1
InChIKey
JYMJWURAJYXCMG-YHCMTOLSSA-N
Synonyms

(1R2R)1((3methoxyphenyl)carbonyl)2(4nitrophenyl)12dihydro3aHspiro(indene23pyrrolo(12a)quinoline)13dione
(1R2R)1(3methoxybenzoyl)2(4nitrophenyl)23adihydro1Hspiro(indene23pyrrolo(12a)quinoline)13dione
(1R2R)1(3methoxybenzoyl)2(4nitrophenyl)spiro(23adihydro1Hpyrrolo(12a)quinoline32indene)13dione
COC1=CC=CC(=C1)C(=O)C2C(C3(C4N2C5=CC=CC=C5C=C4)C(=O)C6=CC=CC=C6C3=O)C7=CC=C(C=C7)(N+)(=O)(O)
COc1cccc(c1)C(=O)(C@@H)1N2c3ccccc3C=CC2(C@@)2((C@H)1c1ccc(cc1)(N+)(=O)(O))C(=O)c1c(C2=O)cccc1
COc1cccc(c1)C(=O)(C@@H)1N2c3ccccc3C=CC2C2((C@H)1c1ccc(cc1)(N+)(=O)(O))C(=O)c1c(C2=O)cccc1
InChI=1SC34H24N2O6c1422496822(1924)31(37)3029(21131623(171421)36(40)41)34(32(38)2510341126(25)33(34)39)281815207251227(20)35(28)30h2192830H1H3t28?2930+m0s1
MFCD18192760
ZINC000001896809
ZINC000102894777

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Available files

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