Vitas-M small molecule compound

ethyl 1-butyl-2-methyl-5-[(naphthalen-1-ylcarbonyl)oxy]-1H-benzo[g]indole-3-carboxylate

Catalog ID
STK869877
SMILES CCCCn1c(C)c(c2c1c1ccccc1c(c2)OC(=O)c1cccc2c1cccc2)C(=O)OCC

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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 C31H29NO4 MW 479.58 g/mol Purity >90% as per NMR
InChI
InChI=1S/C31H29NO4/c1-4-6-18-32-20(3)28(31(34)35-5-2)26-19-27(23-15-9-10-16-24(23)29(26)32)36-30(33)25-17-11-13-21-12-7-8-14-22(21)25/h7-17,19H,4-6,18H2,1-3H3
InChIKey
CTVDXDLQQTXMOA-UHFFFAOYSA-N
Synonyms

CCCCN1C(=C(C2=C1C3=CC=CC=C3C(=C2)OC(=O)C4=CC=CC5=CC=CC=C54)C(=O)OCC)C
ethyl1butyl2methyl5((naphthalen1ylcarbonyl)oxy)1Hbenzo(g)indole3carboxylate
ETHYL1BUTYL2METHYL5(NAPHTHALENE1CARBONYLOXY)BENZO(G)INDOLE3CARBOXYLATE
ethyl5((1naphthoyl)oxy)1butyl2methyl1Hbenzo(g)indole3carboxylate
InChI=1SC31H29NO4c146183220(3)28(31(34)3552)261927(23159101624(23)29(26)32)3630(33)251711132112781422(21)25h71719H4618H213H3
MFCD01959130
ZINC000002288439
ZINC02288439
ZINC2288439

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.