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

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

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)CNC(=O)CCCC2=CNC3=CC=CC=C32

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)CNC(=O)CCCC2=CNC3=CC=CC=C32

InChI

InChI=1S/C21H22N2O3/c1-26-21(25)16-11-9-15(10-12-16)13-23-20(24)8-4-5-17-14-22-19-7-3-2-6-18(17)19/h2-3,6-7,9-12,14,22H,4-5,8,13H2,1H3,(H,23,24)