(4-chloranyl-3-nitro-phenyl)methyl-[1-(phenylmethyl)piperidin-1-ium-4-yl]azanium

Systemtic Name: (4-chloranyl-3-nitro-phenyl)methyl-[1-(phenylmethyl)piperidin-1-ium-4-yl]azanium Openeye Name: (1-benzylpiperidin-1-ium-4-yl)-[(4-chloro-3-nitro-phenyl)methyl]ammonium CAS Name: (4-chloro-3-nitrophenyl)methyl-[1-(phenylmethyl)-4-piperidin-1-iumyl]ammonium IUPAC Name: (1-benzylpiperidin-1-ium-4-yl)-[(4-chloro-3-nitrophenyl)methyl]azanium Traditional Name: (1-benzylpiperidin-1-ium-4-yl)-(4-chloro-3-nitro-benzyl)ammonium Formula: C19H24ClN3O2+2 MolecularWeight: 361.86576

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CCC1[NH2+]CC2=CC(=C(C=C2)Cl)[N+](=O)[O-])CC3=CC=CC=C3

Isomeric SMILES

C1C[NH+](CCC1[NH2+]CC2=CC(=C(C=C2)Cl)[N+](=O)[O-])CC3=CC=CC=C3

InChI

InChI=1S/C19H22ClN3O2/c20-18-7-6-16(12-19(18)23(24)25)13-21-17-8-10-22(11-9-17)14-15-4-2-1-3-5-15/h1-7,12,17,21H,8-11,13-14H2/p+2