methyl 5-methyl-3-(2-phenylbutanoylamino)-1H-indole-2-carboxylate

Systemtic Name: methyl 5-methyl-3-(2-phenylbutanoylamino)-1H-indole-2-carboxylate Openeye Name: methyl 5-methyl-3-(2-phenylbutanoylamino)-1H-indole-2-carboxylate CAS Name: 5-methyl-3-[(1-oxo-2-phenylbutyl)amino]-1H-indole-2-carboxylic acid methyl ester IUPAC Name: methyl 5-methyl-3-(2-phenylbutanoylamino)-1H-indole-2-carboxylate Traditional Name: 5-methyl-3-(2-phenylbutanoylamino)-1H-indole-2-carboxylic acid methyl ester Formula: C21H22N2O3 MolecularWeight: 350.41098

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C1=CC=CC=C1)C(=O)NC2=C(NC3=C2C=C(C=C3)C)C(=O)OC

Isomeric SMILES

CCC(C1=CC=CC=C1)C(=O)NC2=C(NC3=C2C=C(C=C3)C)C(=O)OC

InChI

InChI=1S/C21H22N2O3/c1-4-15(14-8-6-5-7-9-14)20(24)23-18-16-12-13(2)10-11-17(16)22-19(18)21(25)26-3/h5-12,15,22H,4H2,1-3H3,(H,23,24)