N-[(Z)-(2,4-dimethoxyphenyl)methylideneamino]-1-[(4-nitrophenyl)methyl]piperidin-1-ium-4-carboxamide

Systemtic Name: N-[(Z)-(2,4-dimethoxyphenyl)methylideneamino]-1-[(4-nitrophenyl)methyl]piperidin-1-ium-4-carboxamide Openeye Name: N-[(Z)-(2,4-dimethoxyphenyl)methyleneamino]-1-[(4-nitrophenyl)methyl]piperidin-1-ium-4-carboxamide CAS Name: N-[(Z)-(2,4-dimethoxyphenyl)methylideneamino]-1-[(4-nitrophenyl)methyl]-4-piperidin-1-iumcarboxamide IUPAC Name: N-[(Z)-(2,4-dimethoxyphenyl)methylideneamino]-1-[(4-nitrophenyl)methyl]piperidin-1-ium-4-carboxamide Traditional Name: N-[(Z)-(2,4-dimethoxybenzylidene)amino]-1-(4-nitrobenzyl)piperidin-1-ium-4-carboxamide Formula: C22H27N4O5+ MolecularWeight: 427.47358

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)C=NNC(=O)C2CC[NH+](CC2)CC3=CC=C(C=C3)[N+](=O)[O-])OC

Isomeric SMILES

COC1=CC(=C(C=C1)/C=N\NC(=O)C2CC[NH+](CC2)CC3=CC=C(C=C3)[N+](=O)[O-])OC

InChI

InChI=1S/C22H26N4O5/c1-30-20-8-5-18(21(13-20)31-2)14-23-24-22(27)17-9-11-25(12-10-17)15-16-3-6-19(7-4-16)26(28)29/h3-8,13-14,17H,9-12,15H2,1-2H3,(H,24,27)/p+1/b23-14-