N-(4-bromophenyl)-1-[(3-nitrophenyl)methyl]piperidin-1-ium-4-amine

Systemtic Name: N-(4-bromophenyl)-1-[(3-nitrophenyl)methyl]piperidin-1-ium-4-amine Openeye Name: N-(4-bromophenyl)-1-[(3-nitrophenyl)methyl]piperidin-1-ium-4-amine CAS Name: N-(4-bromophenyl)-1-[(3-nitrophenyl)methyl]-4-piperidin-1-iumamine IUPAC Name: N-(4-bromophenyl)-1-[(3-nitrophenyl)methyl]piperidin-1-ium-4-amine Traditional Name: (4-bromophenyl)-[1-(3-nitrobenzyl)piperidin-1-ium-4-yl]amine Formula: C18H21BrN3O2+ MolecularWeight: 391.28224

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CCC1NC2=CC=C(C=C2)Br)CC3=CC(=CC=C3)[N+](=O)[O-]

Isomeric SMILES

C1C[NH+](CCC1NC2=CC=C(C=C2)Br)CC3=CC(=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C18H20BrN3O2/c19-15-4-6-16(7-5-15)20-17-8-10-21(11-9-17)13-14-2-1-3-18(12-14)22(23)24/h1-7,12,17,20H,8-11,13H2/p+1