3-chloranyl-4-[[4-(phenylmethyl)piperidin-1-ium-1-yl]methyl]aniline

Systemtic Name: 3-chloranyl-4-[[4-(phenylmethyl)piperidin-1-ium-1-yl]methyl]aniline Openeye Name: 4-[(4-benzylpiperidin-1-ium-1-yl)methyl]-3-chloro-aniline CAS Name: 3-chloro-4-[[4-(phenylmethyl)-1-piperidin-1-iumyl]methyl]aniline IUPAC Name: 4-[(4-benzylpiperidin-1-ium-1-yl)methyl]-3-chloroaniline Traditional Name: [4-[(4-benzylpiperidin-1-ium-1-yl)methyl]-3-chloro-phenyl]amine Formula: C19H24ClN2+ MolecularWeight: 315.86026

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CCC1CC2=CC=CC=C2)CC3=C(C=C(C=C3)N)Cl

Isomeric SMILES

C1C[NH+](CCC1CC2=CC=CC=C2)CC3=C(C=C(C=C3)N)Cl

InChI

InChI=1S/C19H23ClN2/c20-19-13-18(21)7-6-17(19)14-22-10-8-16(9-11-22)12-15-4-2-1-3-5-15/h1-7,13,16H,8-12,14,21H2/p+1