1-[(2-bromophenyl)methyl]-N-(2-methoxy-5-nitro-phenyl)piperidin-1-ium-4-amine

Systemtic Name: 1-[(2-bromophenyl)methyl]-N-(2-methoxy-5-nitro-phenyl)piperidin-1-ium-4-amine Openeye Name: 1-[(2-bromophenyl)methyl]-N-(2-methoxy-5-nitro-phenyl)piperidin-1-ium-4-amine CAS Name: 1-[(2-bromophenyl)methyl]-N-(2-methoxy-5-nitrophenyl)-4-piperidin-1-iumamine IUPAC Name: 1-[(2-bromophenyl)methyl]-N-(2-methoxy-5-nitrophenyl)piperidin-1-ium-4-amine Traditional Name: [1-(2-bromobenzyl)piperidin-1-ium-4-yl]-(2-methoxy-5-nitro-phenyl)amine Formula: C19H23BrN3O3+ MolecularWeight: 421.30822

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)[N+](=O)[O-])NC2CC[NH+](CC2)CC3=CC=CC=C3Br

Isomeric SMILES

COC1=C(C=C(C=C1)[N+](=O)[O-])NC2CC[NH+](CC2)CC3=CC=CC=C3Br

InChI

InChI=1S/C19H22BrN3O3/c1-26-19-7-6-16(23(24)25)12-18(19)21-15-8-10-22(11-9-15)13-14-4-2-3-5-17(14)20/h2-7,12,15,21H,8-11,13H2,1H3/p+1