1-[1-[(4-chloranyl-2-nitro-phenyl)amino]-1-oxidanylidene-propan-2-yl]-N-phenyl-piperidine-4-carboxamide

Systemtic Name: 1-[1-[(4-chloranyl-2-nitro-phenyl)amino]-1-oxidanylidene-propan-2-yl]-N-phenyl-piperidine-4-carboxamide Openeye Name: 1-[2-(4-chloro-2-nitro-anilino)-1-methyl-2-oxo-ethyl]-N-phenyl-piperidine-4-carboxamide CAS Name: 1-[1-(4-chloro-2-nitroanilino)-1-oxopropan-2-yl]-N-phenyl-4-piperidinecarboxamide IUPAC Name: 1-[1-(4-chloro-2-nitroanilino)-1-oxopropan-2-yl]-N-phenylpiperidine-4-carboxamide Traditional Name: 1-[2-(4-chloro-2-nitro-anilino)-2-keto-1-methyl-ethyl]-N-phenyl-isonipecotamide Formula: C21H23ClN4O4 MolecularWeight: 430.88472

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=C(C=C(C=C1)Cl)[N+](=O)[O-])N2CCC(CC2)C(=O)NC3=CC=CC=C3

Isomeric SMILES

CC(C(=O)NC1=C(C=C(C=C1)Cl)[N+](=O)[O-])N2CCC(CC2)C(=O)NC3=CC=CC=C3

InChI

InChI=1S/C21H23ClN4O4/c1-14(20(27)24-18-8-7-16(22)13-19(18)26(29)30)25-11-9-15(10-12-25)21(28)23-17-5-3-2-4-6-17/h2-8,13-15H,9-12H2,1H3,(H,23,28)(H,24,27)