N-[(Z)-1-(4-methylphenyl)ethylideneamino]-1-[(4-nitrophenyl)methyl]piperidin-1-ium-4-carboxamide

Systemtic Name: N-[(Z)-1-(4-methylphenyl)ethylideneamino]-1-[(4-nitrophenyl)methyl]piperidin-1-ium-4-carboxamide Openeye Name: 1-[(4-nitrophenyl)methyl]-N-[(Z)-1-(p-tolyl)ethylideneamino]piperidin-1-ium-4-carboxamide CAS Name: N-[(Z)-1-(4-methylphenyl)ethylideneamino]-1-[(4-nitrophenyl)methyl]-4-piperidin-1-iumcarboxamide IUPAC Name: N-[(Z)-1-(4-methylphenyl)ethylideneamino]-1-[(4-nitrophenyl)methyl]piperidin-1-ium-4-carboxamide Traditional Name: 1-(4-nitrobenzyl)-N-[(Z)-1-(p-tolyl)ethylideneamino]piperidin-1-ium-4-carboxamide Formula: C22H27N4O3+ MolecularWeight: 395.47478

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=NNC(=O)C2CC[NH+](CC2)CC3=CC=C(C=C3)[N+](=O)[O-])C

Isomeric SMILES

CC1=CC=C(C=C1)/C(=N\NC(=O)C2CC[NH+](CC2)CC3=CC=C(C=C3)[N+](=O)[O-])/C

InChI

InChI=1S/C22H26N4O3/c1-16-3-7-19(8-4-16)17(2)23-24-22(27)20-11-13-25(14-12-20)15-18-5-9-21(10-6-18)26(28)29/h3-10,20H,11-15H2,1-2H3,(H,24,27)/p+1/b23-17-