methyl 4-[[2-(1H-indol-3-yl)ethylcarbamoylamino]methyl]benzoate

Systemtic Name: methyl 4-[[2-(1H-indol-3-yl)ethylcarbamoylamino]methyl]benzoate Openeye Name: methyl 4-[[2-(1H-indol-3-yl)ethylcarbamoylamino]methyl]benzoate CAS Name: 4-[[[[2-(1H-indol-3-yl)ethylamino]-oxomethyl]amino]methyl]benzoic acid methyl ester IUPAC Name: methyl 4-[[2-(1H-indol-3-yl)ethylcarbamoylamino]methyl]benzoate Traditional Name: 4-[[2-(1H-indol-3-yl)ethylcarbamoylamino]methyl]benzoic acid methyl ester Formula: C20H21N3O3 MolecularWeight: 351.39904

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)CNC(=O)NCCC2=CNC3=CC=CC=C32

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)CNC(=O)NCCC2=CNC3=CC=CC=C32

InChI

InChI=1S/C20H21N3O3/c1-26-19(24)15-8-6-14(7-9-15)12-23-20(25)21-11-10-16-13-22-18-5-3-2-4-17(16)18/h2-9,13,22H,10-12H2,1H3,(H2,21,23,25)