methyl 3-methoxy-4-[[1-methyl-5-(3-methylbutylcarbamoyl)indol-3-yl]methyl]benzoate

Systemtic Name: methyl 3-methoxy-4-[[1-methyl-5-(3-methylbutylcarbamoyl)indol-3-yl]methyl]benzoate Openeye Name: methyl 4-[[5-(isopentylcarbamoyl)-1-methyl-indol-3-yl]methyl]-3-methoxy-benzoate CAS Name: 3-methoxy-4-[[1-methyl-5-[(3-methylbutylamino)-oxomethyl]-3-indolyl]methyl]benzoic acid methyl ester IUPAC Name: methyl 3-methoxy-4-[[1-methyl-5-(3-methylbutylcarbamoyl)indol-3-yl]methyl]benzoate Traditional Name: 4-[[5-(isoamylcarbamoyl)-1-methyl-indol-3-yl]methyl]-3-methoxy-benzoic acid methyl ester Formula: C25H30N2O4 MolecularWeight: 422.5167

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCNC(=O)C1=CC2=C(C=C1)N(C=C2CC3=C(C=C(C=C3)C(=O)OC)OC)C

Isomeric SMILES

CC(C)CCNC(=O)C1=CC2=C(C=C1)N(C=C2CC3=C(C=C(C=C3)C(=O)OC)OC)C

InChI

InChI=1S/C25H30N2O4/c1-16(2)10-11-26-24(28)18-8-9-22-21(13-18)20(15-27(22)3)12-17-6-7-19(25(29)31-5)14-23(17)30-4/h6-9,13-16H,10-12H2,1-5H3,(H,26,28)