1-[(4-bromophenyl)methyl]-N-[(Z)-1-naphthalen-2-ylethylideneamino]piperidin-1-ium-4-carboxamide

Systemtic Name: 1-[(4-bromophenyl)methyl]-N-[(Z)-1-naphthalen-2-ylethylideneamino]piperidin-1-ium-4-carboxamide Openeye Name: 1-[(4-bromophenyl)methyl]-N-[(Z)-1-(2-naphthyl)ethylideneamino]piperidin-1-ium-4-carboxamide CAS Name: 1-[(4-bromophenyl)methyl]-N-[(Z)-1-(2-naphthalenyl)ethylideneamino]-4-piperidin-1-iumcarboxamide IUPAC Name: 1-[(4-bromophenyl)methyl]-N-[(Z)-1-naphthalen-2-ylethylideneamino]piperidin-1-ium-4-carboxamide Traditional Name: 1-(4-bromobenzyl)-N-[(Z)-1-(2-naphthyl)ethylideneamino]piperidin-1-ium-4-carboxamide Formula: C25H27BrN3O+ MolecularWeight: 465.40538

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Descriptors Computed from Structure

Canonical SMILES:

CC(=NNC(=O)C1CC[NH+](CC1)CC2=CC=C(C=C2)Br)C3=CC4=CC=CC=C4C=C3

Isomeric SMILES

C/C(=N/NC(=O)C1CC[NH+](CC1)CC2=CC=C(C=C2)Br)/C3=CC4=CC=CC=C4C=C3

InChI

InChI=1S/C25H26BrN3O/c1-18(22-9-8-20-4-2-3-5-23(20)16-22)27-28-25(30)21-12-14-29(15-13-21)17-19-6-10-24(26)11-7-19/h2-11,16,21H,12-15,17H2,1H3,(H,28,30)/p+1/b27-18-