1-[(4-chlorophenyl)methyl]-N-[(E)-1-(4-nitrophenyl)ethylideneamino]piperidin-1-ium-4-carboxamide

Systemtic Name: 1-[(4-chlorophenyl)methyl]-N-[(E)-1-(4-nitrophenyl)ethylideneamino]piperidin-1-ium-4-carboxamide Openeye Name: 1-[(4-chlorophenyl)methyl]-N-[(E)-1-(4-nitrophenyl)ethylideneamino]piperidin-1-ium-4-carboxamide CAS Name: 1-[(4-chlorophenyl)methyl]-N-[(E)-1-(4-nitrophenyl)ethylideneamino]-4-piperidin-1-iumcarboxamide IUPAC Name: 1-[(4-chlorophenyl)methyl]-N-[(E)-1-(4-nitrophenyl)ethylideneamino]piperidin-1-ium-4-carboxamide Traditional Name: 1-(4-chlorobenzyl)-N-[(E)-1-(4-nitrophenyl)ethylideneamino]piperidin-1-ium-4-carboxamide Formula: C21H24ClN4O3+ MolecularWeight: 415.89326

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Descriptors Computed from Structure

Canonical SMILES:

CC(=NNC(=O)C1CC[NH+](CC1)CC2=CC=C(C=C2)Cl)C3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

C/C(=N\NC(=O)C1CC[NH+](CC1)CC2=CC=C(C=C2)Cl)/C3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C21H23ClN4O3/c1-15(17-4-8-20(9-5-17)26(28)29)23-24-21(27)18-10-12-25(13-11-18)14-16-2-6-19(22)7-3-16/h2-9,18H,10-14H2,1H3,(H,24,27)/p+1/b23-15+