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

Systemtic Name: 1-[(4-nitrophenyl)methyl]-N-[(Z)-(3-nitrophenyl)methylideneamino]piperidin-1-ium-4-carboxamide Openeye Name: 1-[(4-nitrophenyl)methyl]-N-[(Z)-(3-nitrophenyl)methyleneamino]piperidin-1-ium-4-carboxamide CAS Name: 1-[(4-nitrophenyl)methyl]-N-[(Z)-(3-nitrophenyl)methylideneamino]-4-piperidin-1-iumcarboxamide IUPAC Name: 1-[(4-nitrophenyl)methyl]-N-[(Z)-(3-nitrophenyl)methylideneamino]piperidin-1-ium-4-carboxamide Traditional Name: 1-(4-nitrobenzyl)-N-[(Z)-(3-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(=CC=C2)[N+](=O)[O-])CC3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

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

InChI

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