(3S)-1-(4-chlorophenyl)-N-(2-methoxy-5-nitro-phenyl)-5-oxidanylidene-pyrrolidine-3-carboxamide

Systemtic Name: (3S)-1-(4-chlorophenyl)-N-(2-methoxy-5-nitro-phenyl)-5-oxidanylidene-pyrrolidine-3-carboxamide Openeye Name: (3S)-1-(4-chlorophenyl)-N-(2-methoxy-5-nitro-phenyl)-5-oxo-pyrrolidine-3-carboxamide CAS Name: (3S)-1-(4-chlorophenyl)-N-(2-methoxy-5-nitrophenyl)-5-oxo-3-pyrrolidinecarboxamide IUPAC Name: (3S)-1-(4-chlorophenyl)-N-(2-methoxy-5-nitrophenyl)-5-oxopyrrolidine-3-carboxamide Traditional Name: (3S)-1-(4-chlorophenyl)-5-keto-N-(2-methoxy-5-nitro-phenyl)pyrrolidine-3-carboxamide Formula: C18H16ClN3O5 MolecularWeight: 389.78974

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)[N+](=O)[O-])NC(=O)C2CC(=O)N(C2)C3=CC=C(C=C3)Cl

Isomeric SMILES

COC1=C(C=C(C=C1)[N+](=O)[O-])NC(=O)[C@H]2CC(=O)N(C2)C3=CC=C(C=C3)Cl

InChI

InChI=1S/C18H16ClN3O5/c1-27-16-7-6-14(22(25)26)9-15(16)20-18(24)11-8-17(23)21(10-11)13-4-2-12(19)3-5-13/h2-7,9,11H,8,10H2,1H3,(H,20,24)/t11-/m0/s1