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

Systemtic Name: 1-[(4-nitrophenyl)methyl]-N-[(Z)-(4-nitrophenyl)methylideneamino]piperidin-1-ium-4-carboxamide Openeye Name: 1-[(4-nitrophenyl)methyl]-N-[(Z)-(4-nitrophenyl)methyleneamino]piperidin-1-ium-4-carboxamide CAS Name: 1-[(4-nitrophenyl)methyl]-N-[(Z)-(4-nitrophenyl)methylideneamino]-4-piperidin-1-iumcarboxamide IUPAC Name: 1-[(4-nitrophenyl)methyl]-N-[(Z)-(4-nitrophenyl)methylideneamino]piperidin-1-ium-4-carboxamide Traditional Name: 1-(4-nitrobenzyl)-N-[(Z)-(4-nitrobenzylidene)amino]piperidin-1-ium-4-carboxamide Formula: C20H22N5O5+ MolecularWeight: 412.41918

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CCC1C(=O)NN=CC2=CC=C(C=C2)[N+](=O)[O-])CC3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

C1C[NH+](CCC1C(=O)N/N=C\C2=CC=C(C=C2)[N+](=O)[O-])CC3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C20H21N5O5/c26-20(22-21-13-15-1-5-18(6-2-15)24(27)28)17-9-11-23(12-10-17)14-16-3-7-19(8-4-16)25(29)30/h1-8,13,17H,9-12,14H2,(H,22,26)/p+1/b21-13-