methyl 4-[[3-(2-chlorophenyl)propanoylamino]methyl]benzoate

Systemtic Name: methyl 4-[[3-(2-chlorophenyl)propanoylamino]methyl]benzoate Openeye Name: methyl 4-[[3-(2-chlorophenyl)propanoylamino]methyl]benzoate CAS Name: 4-[[[3-(2-chlorophenyl)-1-oxopropyl]amino]methyl]benzoic acid methyl ester IUPAC Name: methyl 4-[[3-(2-chlorophenyl)propanoylamino]methyl]benzoate Traditional Name: 4-[[3-(2-chlorophenyl)propanoylamino]methyl]benzoic acid methyl ester Formula: C18H18ClNO3 MolecularWeight: 331.79342

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)CNC(=O)CCC2=CC=CC=C2Cl

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)CNC(=O)CCC2=CC=CC=C2Cl

InChI

InChI=1S/C18H18ClNO3/c1-23-18(22)15-8-6-13(7-9-15)12-20-17(21)11-10-14-4-2-3-5-16(14)19/h2-9H,10-12H2,1H3,(H,20,21)