N-[(E)-1-(4-methyl-3-nitro-phenyl)ethylideneamino]-2-oxidanylidene-piperidine-3-carboxamide

Systemtic Name: N-[(E)-1-(4-methyl-3-nitro-phenyl)ethylideneamino]-2-oxidanylidene-piperidine-3-carboxamide Openeye Name: N-[(E)-1-(4-methyl-3-nitro-phenyl)ethylideneamino]-2-oxo-piperidine-3-carboxamide CAS Name: N-[(E)-1-(4-methyl-3-nitrophenyl)ethylideneamino]-2-oxo-3-piperidinecarboxamide IUPAC Name: N-[(E)-1-(4-methyl-3-nitrophenyl)ethylideneamino]-2-oxopiperidine-3-carboxamide Traditional Name: 2-keto-N-[(E)-1-(4-methyl-3-nitro-phenyl)ethylideneamino]nipecotamide Formula: C15H18N4O4 MolecularWeight: 318.32782

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=NNC(=O)C2CCCNC2=O)C)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=C(C=C1)/C(=N/NC(=O)C2CCCNC2=O)/C)[N+](=O)[O-]

InChI

InChI=1S/C15H18N4O4/c1-9-5-6-11(8-13(9)19(22)23)10(2)17-18-15(21)12-4-3-7-16-14(12)20/h5-6,8,12H,3-4,7H2,1-2H3,(H,16,20)(H,18,21)/b17-10+