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

Systemtic Name: 1-[(4-bromophenyl)methyl]-N-[(Z)-(3-phenoxyphenyl)methylideneamino]piperidin-1-ium-4-carboxamide Openeye Name: 1-[(4-bromophenyl)methyl]-N-[(Z)-(3-phenoxyphenyl)methyleneamino]piperidin-1-ium-4-carboxamide CAS Name: 1-[(4-bromophenyl)methyl]-N-[(Z)-(3-phenoxyphenyl)methylideneamino]-4-piperidin-1-iumcarboxamide IUPAC Name: 1-[(4-bromophenyl)methyl]-N-[(Z)-(3-phenoxyphenyl)methylideneamino]piperidin-1-ium-4-carboxamide Traditional Name: 1-(4-bromobenzyl)-N-[(Z)-(3-phenoxybenzylidene)amino]piperidin-1-ium-4-carboxamide Formula: C26H27BrN3O2+ MolecularWeight: 493.41548

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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)Br

Isomeric SMILES

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

InChI

InChI=1S/C26H26BrN3O2/c27-23-11-9-20(10-12-23)19-30-15-13-22(14-16-30)26(31)29-28-18-21-5-4-8-25(17-21)32-24-6-2-1-3-7-24/h1-12,17-18,22H,13-16,19H2,(H,29,31)/p+1/b28-18-