N-[1-[2-[(2-nitrophenyl)amino]-2-oxidanylidene-ethyl]piperidin-1-ium-4-yl]cyclopropanecarboxamide

Systemtic Name: N-[1-[2-[(2-nitrophenyl)amino]-2-oxidanylidene-ethyl]piperidin-1-ium-4-yl]cyclopropanecarboxamide Openeye Name: N-[1-[2-(2-nitroanilino)-2-oxo-ethyl]piperidin-1-ium-4-yl]cyclopropanecarboxamide CAS Name: N-[1-[2-(2-nitroanilino)-2-oxoethyl]-4-piperidin-1-iumyl]cyclopropanecarboxamide IUPAC Name: N-[1-[2-(2-nitroanilino)-2-oxoethyl]piperidin-1-ium-4-yl]cyclopropanecarboxamide Traditional Name: N-[1-[2-keto-2-(2-nitroanilino)ethyl]piperidin-1-ium-4-yl]cyclopropanecarboxamide Formula: C17H23N4O4+ MolecularWeight: 347.38892

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1C(=O)NC2CC[NH+](CC2)CC(=O)NC3=CC=CC=C3[N+](=O)[O-]

Isomeric SMILES

C1CC1C(=O)NC2CC[NH+](CC2)CC(=O)NC3=CC=CC=C3[N+](=O)[O-]

InChI

InChI=1S/C17H22N4O4/c22-16(19-14-3-1-2-4-15(14)21(24)25)11-20-9-7-13(8-10-20)18-17(23)12-5-6-12/h1-4,12-13H,5-11H2,(H,18,23)(H,19,22)/p+1