1-[(4-nitrophenyl)methyl]-N-[(Z)-(3-phenoxyphenyl)methylideneamino]piperidin-1-ium-4-carboxamide

Systemtic Name: 1-[(4-nitrophenyl)methyl]-N-[(Z)-(3-phenoxyphenyl)methylideneamino]piperidin-1-ium-4-carboxamide Openeye Name: 1-[(4-nitrophenyl)methyl]-N-[(Z)-(3-phenoxyphenyl)methyleneamino]piperidin-1-ium-4-carboxamide CAS Name: 1-[(4-nitrophenyl)methyl]-N-[(Z)-(3-phenoxyphenyl)methylideneamino]-4-piperidin-1-iumcarboxamide IUPAC Name: 1-[(4-nitrophenyl)methyl]-N-[(Z)-(3-phenoxyphenyl)methylideneamino]piperidin-1-ium-4-carboxamide Traditional Name: 1-(4-nitrobenzyl)-N-[(Z)-(3-phenoxybenzylidene)amino]piperidin-1-ium-4-carboxamide Formula: C26H27N4O4+ MolecularWeight: 459.51698

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CCC1C(=O)NN=CC2=CC(=CC=C2)OC3=CC=CC=C3)CC4=CC=C(C=C4)[N+](=O)[O-]

Isomeric SMILES

C1C[NH+](CCC1C(=O)N/N=C\C2=CC(=CC=C2)OC3=CC=CC=C3)CC4=CC=C(C=C4)[N+](=O)[O-]

InChI

InChI=1S/C26H26N4O4/c31-26(22-13-15-29(16-14-22)19-20-9-11-23(12-10-20)30(32)33)28-27-18-21-5-4-8-25(17-21)34-24-6-2-1-3-7-24/h1-12,17-18,22H,13-16,19H2,(H,28,31)/p+1/b27-18-