Vitas-M small molecule compound

2-(4-chlorophenyl)-2-oxoethyl 6,7,8,9,10,11,12,13,14,15-decahydrocyclododeca[b]quinoline-16-carboxylate

Catalog ID
STK535515
SMILES Clc1ccc(cc1)C(=O)COC(=O)c1c2CCCCCCCCCCc2nc2c1cccc2

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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 C28H30ClNO3 MW 464.00 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H30ClNO3/c29-21-17-15-20(16-18-21)26(31)19-33-28(32)27-22-11-7-5-3-1-2-4-6-8-13-24(22)30-25-14-10-9-12-23(25)27/h9-10,12,14-18H,1-8,11,13,19H2
InChIKey
XJYXFGIVYZPPPV-UHFFFAOYSA-N
Synonyms

(2(4chlorophenyl)2oxoethyl)6789101112131415decahydrocyclododeca(b)quinoline16carboxylate
2(4chlorophenyl)2oxoethyl6789101112131415decahydrocyclododeca(b)quinoline16carboxylate
C1CCCCCC2=NC3=CC=CC=C3C(=C2CCCC1)C(=O)OCC(=O)C4=CC=C(C=C4)Cl
InChI=1SC28H30ClNO3c2921171520(161821)26(31)193328(32)272211753124681324(22)3025141091223(25)27h910121418H18111319H2
MFCD02041136
ZINC000002078784
ZINC02078784
ZINC2078784

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Available files

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