2-[1-(4-chlorophenyl)carbonyl-5-methoxy-2-methyl-indol-3-yl]ethyl 4-methylbenzoate

Systemtic Name: 2-[1-(4-chlorophenyl)carbonyl-5-methoxy-2-methyl-indol-3-yl]ethyl 4-methylbenzoate Openeye Name: 2-[1-(4-chlorobenzoyl)-5-methoxy-2-methyl-indol-3-yl]ethyl 4-methylbenzoate CAS Name: 4-methylbenzoic acid 2-[1-[(4-chlorophenyl)-oxomethyl]-5-methoxy-2-methyl-3-indolyl]ethyl ester IUPAC Name: 2-[1-(4-chlorobenzoyl)-5-methoxy-2-methylindol-3-yl]ethyl 4-methylbenzoate Traditional Name: 4-methylbenzoic acid 2-[1-(4-chlorobenzoyl)-5-methoxy-2-methyl-indol-3-yl]ethyl ester Formula: C27H24ClNO4 MolecularWeight: 461.93676

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)OCCC2=C(N(C3=C2C=C(C=C3)OC)C(=O)C4=CC=C(C=C4)Cl)C

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)OCCC2=C(N(C3=C2C=C(C=C3)OC)C(=O)C4=CC=C(C=C4)Cl)C

InChI

InChI=1S/C27H24ClNO4/c1-17-4-6-20(7-5-17)27(31)33-15-14-23-18(2)29(25-13-12-22(32-3)16-24(23)25)26(30)19-8-10-21(28)11-9-19/h4-13,16H,14-15H2,1-3H3