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

Systemtic Name: methyl 4-[[3-(4-chlorophenyl)propanoylamino]methyl]benzoate Openeye Name: methyl 4-[[3-(4-chlorophenyl)propanoylamino]methyl]benzoate CAS Name: 4-[[[3-(4-chlorophenyl)-1-oxopropyl]amino]methyl]benzoic acid methyl ester IUPAC Name: methyl 4-[[3-(4-chlorophenyl)propanoylamino]methyl]benzoate Traditional Name: 4-[[3-(4-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=C(C=C2)Cl

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)CNC(=O)CCC2=CC=C(C=C2)Cl

InChI

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