methyl 3-(2-phenylbutanoylamino)-1H-indole-2-carboxylate

Systemtic Name: methyl 3-(2-phenylbutanoylamino)-1H-indole-2-carboxylate Openeye Name: methyl 3-(2-phenylbutanoylamino)-1H-indole-2-carboxylate CAS Name: 3-[(1-oxo-2-phenylbutyl)amino]-1H-indole-2-carboxylic acid methyl ester IUPAC Name: methyl 3-(2-phenylbutanoylamino)-1H-indole-2-carboxylate Traditional Name: 3-(2-phenylbutanoylamino)-1H-indole-2-carboxylic acid methyl ester Formula: C20H20N2O3 MolecularWeight: 336.3844

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(C1=CC=CC=C1)C(=O)NC2=C(NC3=CC=CC=C32)C(=O)OC

Isomeric SMILES

CCC(C1=CC=CC=C1)C(=O)NC2=C(NC3=CC=CC=C32)C(=O)OC

InChI

InChI=1S/C20H20N2O3/c1-3-14(13-9-5-4-6-10-13)19(23)22-17-15-11-7-8-12-16(15)21-18(17)20(24)25-2/h4-12,14,21H,3H2,1-2H3,(H,22,23)