methyl 3-[4-(1H-indol-3-yl)butanoylamino]-4-methyl-benzoate

Systemtic Name: methyl 3-[4-(1H-indol-3-yl)butanoylamino]-4-methyl-benzoate Openeye Name: methyl 3-[4-(1H-indol-3-yl)butanoylamino]-4-methyl-benzoate CAS Name: 3-[[4-(1H-indol-3-yl)-1-oxobutyl]amino]-4-methylbenzoic acid methyl ester IUPAC Name: methyl 3-[4-(1H-indol-3-yl)butanoylamino]-4-methylbenzoate Traditional Name: 3-[4-(1H-indol-3-yl)butanoylamino]-4-methyl-benzoic acid methyl ester Formula: C21H22N2O3 MolecularWeight: 350.41098

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)OC)NC(=O)CCCC2=CNC3=CC=CC=C32

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)OC)NC(=O)CCCC2=CNC3=CC=CC=C32

InChI

InChI=1S/C21H22N2O3/c1-14-10-11-15(21(25)26-2)12-19(14)23-20(24)9-5-6-16-13-22-18-8-4-3-7-17(16)18/h3-4,7-8,10-13,22H,5-6,9H2,1-2H3,(H,23,24)