N-[(3-acetamidophenyl)methyl]-1-(5-chloranyl-2-methoxy-phenyl)-5-oxidanylidene-pyrrolidine-3-carboxamide

Systemtic Name: N-[(3-acetamidophenyl)methyl]-1-(5-chloranyl-2-methoxy-phenyl)-5-oxidanylidene-pyrrolidine-3-carboxamide Openeye Name: N-[(3-acetamidophenyl)methyl]-1-(5-chloro-2-methoxy-phenyl)-5-oxo-pyrrolidine-3-carboxamide CAS Name: N-[(3-acetamidophenyl)methyl]-1-(5-chloro-2-methoxyphenyl)-5-oxo-3-pyrrolidinecarboxamide IUPAC Name: N-[(3-acetamidophenyl)methyl]-1-(5-chloro-2-methoxyphenyl)-5-oxopyrrolidine-3-carboxamide Traditional Name: N-(3-acetamidobenzyl)-1-(5-chloro-2-methoxy-phenyl)-5-keto-pyrrolidine-3-carboxamide Formula: C21H22ClN3O4 MolecularWeight: 415.87008

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC=CC(=C1)CNC(=O)C2CC(=O)N(C2)C3=C(C=CC(=C3)Cl)OC

Isomeric SMILES

CC(=O)NC1=CC=CC(=C1)CNC(=O)C2CC(=O)N(C2)C3=C(C=CC(=C3)Cl)OC

InChI

InChI=1S/C21H22ClN3O4/c1-13(26)24-17-5-3-4-14(8-17)11-23-21(28)15-9-20(27)25(12-15)18-10-16(22)6-7-19(18)29-2/h3-8,10,15H,9,11-12H2,1-2H3,(H,23,28)(H,24,26)