1-[(4-bromophenyl)methyl]-N-[(E)-1-(2,4-dimethoxyphenyl)ethylideneamino]piperidin-1-ium-4-carboxamide

Systemtic Name: 1-[(4-bromophenyl)methyl]-N-[(E)-1-(2,4-dimethoxyphenyl)ethylideneamino]piperidin-1-ium-4-carboxamide Openeye Name: 1-[(4-bromophenyl)methyl]-N-[(E)-1-(2,4-dimethoxyphenyl)ethylideneamino]piperidin-1-ium-4-carboxamide CAS Name: 1-[(4-bromophenyl)methyl]-N-[(E)-1-(2,4-dimethoxyphenyl)ethylideneamino]-4-piperidin-1-iumcarboxamide IUPAC Name: 1-[(4-bromophenyl)methyl]-N-[(E)-1-(2,4-dimethoxyphenyl)ethylideneamino]piperidin-1-ium-4-carboxamide Traditional Name: 1-(4-bromobenzyl)-N-[(E)-1-(2,4-dimethoxyphenyl)ethylideneamino]piperidin-1-ium-4-carboxamide Formula: C23H29BrN3O3+ MolecularWeight: 475.39866

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H28BrN3O3/c1-16(21-9-8-20(29-2)14-22(21)30-3)25-26-23(28)18-10-12-27(13-11-18)15-17-4-6-19(24)7-5-17/h4-9,14,18H,10-13,15H2,1-3H3,(H,26,28)/p+1/b25-16+