methyl 4-chloranyl-3-(2-phenylbutanoylamino)benzoate

Systemtic Name: methyl 4-chloranyl-3-(2-phenylbutanoylamino)benzoate Openeye Name: methyl 4-chloro-3-(2-phenylbutanoylamino)benzoate CAS Name: 4-chloro-3-[(1-oxo-2-phenylbutyl)amino]benzoic acid methyl ester IUPAC Name: methyl 4-chloro-3-(2-phenylbutanoylamino)benzoate Traditional Name: 4-chloro-3-(2-phenylbutanoylamino)benzoic acid methyl ester Formula: C18H18ClNO3 MolecularWeight: 331.79342

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C1=CC=CC=C1)C(=O)NC2=C(C=CC(=C2)C(=O)OC)Cl

Isomeric SMILES

CCC(C1=CC=CC=C1)C(=O)NC2=C(C=CC(=C2)C(=O)OC)Cl

InChI

InChI=1S/C18H18ClNO3/c1-3-14(12-7-5-4-6-8-12)17(21)20-16-11-13(18(22)23-2)9-10-15(16)19/h4-11,14H,3H2,1-2H3,(H,20,21)