1-[(2-chlorophenyl)methyl]-N-[2-(4-nitrophenyl)-2-oxidanyl-ethyl]-6-oxidanylidene-pyridine-3-carboxamide

Systemtic Name: 1-[(2-chlorophenyl)methyl]-N-[2-(4-nitrophenyl)-2-oxidanyl-ethyl]-6-oxidanylidene-pyridine-3-carboxamide Openeye Name: 1-[(2-chlorophenyl)methyl]-N-[2-hydroxy-2-(4-nitrophenyl)ethyl]-6-oxo-pyridine-3-carboxamide CAS Name: 1-[(2-chlorophenyl)methyl]-N-[2-hydroxy-2-(4-nitrophenyl)ethyl]-6-oxo-3-pyridinecarboxamide IUPAC Name: 1-[(2-chlorophenyl)methyl]-N-[2-hydroxy-2-(4-nitrophenyl)ethyl]-6-oxopyridine-3-carboxamide Traditional Name: 1-(2-chlorobenzyl)-N-[2-hydroxy-2-(4-nitrophenyl)ethyl]-6-keto-nicotinamide Formula: C21H18ClN3O5 MolecularWeight: 427.83772

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)CN2C=C(C=CC2=O)C(=O)NCC(C3=CC=C(C=C3)[N+](=O)[O-])O)Cl

Isomeric SMILES

C1=CC=C(C(=C1)CN2C=C(C=CC2=O)C(=O)NCC(C3=CC=C(C=C3)[N+](=O)[O-])O)Cl

InChI

InChI=1S/C21H18ClN3O5/c22-18-4-2-1-3-15(18)12-24-13-16(7-10-20(24)27)21(28)23-11-19(26)14-5-8-17(9-6-14)25(29)30/h1-10,13,19,26H,11-12H2,(H,23,28)