1-[2-[[4-nitro-2-(phenylcarbonyl)phenyl]amino]-2-oxidanylidene-ethyl]piperidin-1-ium-4-carboxamide

Systemtic Name: 1-[2-[[4-nitro-2-(phenylcarbonyl)phenyl]amino]-2-oxidanylidene-ethyl]piperidin-1-ium-4-carboxamide Openeye Name: 1-[2-(2-benzoyl-4-nitro-anilino)-2-oxo-ethyl]piperidin-1-ium-4-carboxamide CAS Name: 1-[2-(2-benzoyl-4-nitroanilino)-2-oxoethyl]-4-piperidin-1-iumcarboxamide IUPAC Name: 1-[2-(2-benzoyl-4-nitroanilino)-2-oxoethyl]piperidin-1-ium-4-carboxamide Traditional Name: 1-[2-(2-benzoyl-4-nitro-anilino)-2-keto-ethyl]piperidin-1-ium-4-carboxamide Formula: C21H23N4O5+ MolecularWeight: 411.43112

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CCC1C(=O)N)CC(=O)NC2=C(C=C(C=C2)[N+](=O)[O-])C(=O)C3=CC=CC=C3

Isomeric SMILES

C1C[NH+](CCC1C(=O)N)CC(=O)NC2=C(C=C(C=C2)[N+](=O)[O-])C(=O)C3=CC=CC=C3

InChI

InChI=1S/C21H22N4O5/c22-21(28)15-8-10-24(11-9-15)13-19(26)23-18-7-6-16(25(29)30)12-17(18)20(27)14-4-2-1-3-5-14/h1-7,12,15H,8-11,13H2,(H2,22,28)(H,23,26)/p+1