dimethyl 5-[3-(1H-indol-3-yl)propanoylamino]benzene-1,3-dicarboxylate

Systemtic Name: dimethyl 5-[3-(1H-indol-3-yl)propanoylamino]benzene-1,3-dicarboxylate Openeye Name: dimethyl 5-[3-(1H-indol-3-yl)propanoylamino]benzene-1,3-dicarboxylate CAS Name: 5-[[3-(1H-indol-3-yl)-1-oxopropyl]amino]benzene-1,3-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 5-[3-(1H-indol-3-yl)propanoylamino]benzene-1,3-dicarboxylate Traditional Name: 5-[3-(1H-indol-3-yl)propanoylamino]benzene-1,3-dicarboxylic acid dimethyl ester Formula: C21H20N2O5 MolecularWeight: 380.3939

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=CC(=C1)NC(=O)CCC2=CNC3=CC=CC=C32)C(=O)OC

Isomeric SMILES

COC(=O)C1=CC(=CC(=C1)NC(=O)CCC2=CNC3=CC=CC=C32)C(=O)OC

InChI

InChI=1S/C21H20N2O5/c1-27-20(25)14-9-15(21(26)28-2)11-16(10-14)23-19(24)8-7-13-12-22-18-6-4-3-5-17(13)18/h3-6,9-12,22H,7-8H2,1-2H3,(H,23,24)