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

Systemtic Name: N-[(E)-1-(4-bromophenyl)ethylideneamino]-1-[(4-bromophenyl)methyl]piperidin-1-ium-4-carboxamide Openeye Name: N-[(E)-1-(4-bromophenyl)ethylideneamino]-1-[(4-bromophenyl)methyl]piperidin-1-ium-4-carboxamide CAS Name: N-[(E)-1-(4-bromophenyl)ethylideneamino]-1-[(4-bromophenyl)methyl]-4-piperidin-1-iumcarboxamide IUPAC Name: N-[(E)-1-(4-bromophenyl)ethylideneamino]-1-[(4-bromophenyl)methyl]piperidin-1-ium-4-carboxamide Traditional Name: 1-(4-bromobenzyl)-N-[(E)-1-(4-bromophenyl)ethylideneamino]piperidin-1-ium-4-carboxamide Formula: C21H24Br2N3O+ MolecularWeight: 494.24276

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H23Br2N3O/c1-15(17-4-8-20(23)9-5-17)24-25-21(27)18-10-12-26(13-11-18)14-16-2-6-19(22)7-3-16/h2-9,18H,10-14H2,1H3,(H,25,27)/p+1/b24-15+