methyl 4-[[[3-acetamido-3-(4-chlorophenyl)propanoyl]amino]methyl]benzoate

Systemtic Name: methyl 4-[[[3-acetamido-3-(4-chlorophenyl)propanoyl]amino]methyl]benzoate Openeye Name: methyl 4-[[[3-acetamido-3-(4-chlorophenyl)propanoyl]amino]methyl]benzoate CAS Name: 4-[[[3-acetamido-3-(4-chlorophenyl)-1-oxopropyl]amino]methyl]benzoic acid methyl ester IUPAC Name: methyl 4-[[[3-acetamido-3-(4-chlorophenyl)propanoyl]amino]methyl]benzoate Traditional Name: 4-[[[3-acetamido-3-(4-chlorophenyl)propanoyl]amino]methyl]benzoic acid methyl ester Formula: C20H21ClN2O4 MolecularWeight: 388.84474

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC(CC(=O)NCC1=CC=C(C=C1)C(=O)OC)C2=CC=C(C=C2)Cl

Isomeric SMILES

CC(=O)NC(CC(=O)NCC1=CC=C(C=C1)C(=O)OC)C2=CC=C(C=C2)Cl

InChI

InChI=1S/C20H21ClN2O4/c1-13(24)23-18(15-7-9-17(21)10-8-15)11-19(25)22-12-14-3-5-16(6-4-14)20(26)27-2/h3-10,18H,11-12H2,1-2H3,(H,22,25)(H,23,24)