methyl 4-[[3-(2-methylpropanoylamino)phenyl]methylcarbamoyl]benzoate

Systemtic Name: methyl 4-[[3-(2-methylpropanoylamino)phenyl]methylcarbamoyl]benzoate Openeye Name: methyl 4-[[3-(2-methylpropanoylamino)phenyl]methylcarbamoyl]benzoate CAS Name: 4-[[[3-[(2-methyl-1-oxopropyl)amino]phenyl]methylamino]-oxomethyl]benzoic acid methyl ester IUPAC Name: methyl 4-[[3-(2-methylpropanoylamino)phenyl]methylcarbamoyl]benzoate Traditional Name: 4-[[3-(isobutyrylamino)benzyl]carbamoyl]benzoic acid methyl ester Formula: C20H22N2O4 MolecularWeight: 354.39968

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(=O)NC1=CC=CC(=C1)CNC(=O)C2=CC=C(C=C2)C(=O)OC

Isomeric SMILES

CC(C)C(=O)NC1=CC=CC(=C1)CNC(=O)C2=CC=C(C=C2)C(=O)OC

InChI

InChI=1S/C20H22N2O4/c1-13(2)18(23)22-17-6-4-5-14(11-17)12-21-19(24)15-7-9-16(10-8-15)20(25)26-3/h4-11,13H,12H2,1-3H3,(H,21,24)(H,22,23)