Vitas-M small molecule compound
methyl 2'-(4-methylphenyl)-1,3-dioxo-1,1',2',3-tetrahydro-3a'H-spiro[indene-2,3'-pyrrolo[1,2-a]quinoline]-1'-carboxylate
Catalog ID
STL237784
SMILES COC(=O)C1N2c3ccccc3C=CC2C2(C1c1ccc(cc1)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 C29H23NO4 MW 449.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H23NO4/c1-17-11-13-19(14-12-17)24-25(28(33)34-2)30-22-10-6-3-7-18(22)15-16-23(30)29(24)26(31)20-8-4-5-9-21(20)27(29)32/h3-16,23-25H,1-2H3InChIKey
GHHJGXVNRJTYMV-UHFFFAOYSA-NSynonyms
(1R2R)methyl13dioxo2(ptolyl)1233atetrahydro1Hspiro(indene23pyrrolo(12a)quinoline)1carboxylate
CC1=CC=C(C=C1)C2C(N3C(C24C(=O)C5=CC=CC=C5C4=O)C=CC6=CC=CC=C63)C(=O)OC
COC(=O)(C@@H)1N2c3ccccc3C=CC2C2((C@H)1c1ccc(cc1)C)C(=O)c1c(C2=O)cccc1
InChI=1SC29H23NO4c117111319(141217)2425(28(33)342)30221063718(22)151623(30)29(24)26(31)20845921(20)27(29)32h3162325H12H3
methyl2(4methylphenyl)13dioxo1123tetrahydro3aHspiro(indene23pyrrolo(12a)quinoline)1carboxylate
METHYL2(4METHYLPHENYL)13DIOXOSPIRO(23ADIHYDRO1HPYRROLO(12A)QUINOLINE32INDENE)1CARBOXYLATE
MFCD07209818
ZINC000002222953
ZINC000015996821
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