N-(2-nitrophenyl)-1-(phenylmethyl)piperidin-1-ium-4-amine

Systemtic Name: N-(2-nitrophenyl)-1-(phenylmethyl)piperidin-1-ium-4-amine Openeye Name: 1-benzyl-N-(2-nitrophenyl)piperidin-1-ium-4-amine CAS Name: N-(2-nitrophenyl)-1-(phenylmethyl)-4-piperidin-1-iumamine IUPAC Name: 1-benzyl-N-(2-nitrophenyl)piperidin-1-ium-4-amine Traditional Name: (1-benzylpiperidin-1-ium-4-yl)-(2-nitrophenyl)amine Formula: C18H22N3O2+ MolecularWeight: 312.38618

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H21N3O2/c22-21(23)18-9-5-4-8-17(18)19-16-10-12-20(13-11-16)14-15-6-2-1-3-7-15/h1-9,16,19H,10-14H2/p+1