Vitas-M small molecule compound

methyl (1'R,2'R)-1,3-dioxo-2'-[4-(propan-2-yl)phenyl]-1,1',2',3-tetrahydro-3a'H-spiro[indene-2,3'-pyrrolo[1,2-a]quinoline]-1'-carboxylate

Catalog ID
STL537088
SMILES COC(=O)[C@@H]1N2c3ccccc3C=CC2[C@@]2([C@H]1c1ccc(cc1)C(C)C)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 C31H27NO4 MW 477.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C31H27NO4/c1-18(2)19-12-14-21(15-13-19)26-27(30(35)36-3)32-24-11-7-4-8-20(24)16-17-25(32)31(26)28(33)22-9-5-6-10-23(22)29(31)34/h4-18,25-27H,1-3H3/t25?,26-,27+/m0/s1
InChIKey
HUUXVQGWQGTKNB-GDRMZMBQSA-N
Synonyms
1216946-85-8
(1R2R)methyl2(4isopropylphenyl)13dioxo1233atetrahydro1Hspiro(indene23pyrrolo(12a)quinoline)1carboxylate
1216946858
16399563
COC(=O)(C@@H)1N2c3ccccc3C=CC2C2((C@H)1c1ccc(cc1)C(C)C)C(=O)c1c(C2=O)cccc1
InChI=1SC31H27NO4c118(2)19121421(151319)2627(30(35)363)32241174820(24)161725(32)31(26)28(33)229561023(22)29(31)34h4182527H13H3t25?2627+m0s1
methyl(1~(R)2~(R))13dioxo2(4propan2ylphenyl)spiro(23~(a)dihydro1~(H)pyrrolo(12a)quinoline32indene)1carboxylate
methyl(1R2R)13dioxo2(4(propan2yl)phenyl)1123tetrahydro3aHspiro(indene23pyrrolo(12a)quinoline)1carboxylate
MFCD04144374
ZINC000008917799
ZINC000008917800

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Available files

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