1-[(6-chloranylpyridin-3-yl)methyl]-4-(phenylmethyl)piperazin-1-ium

Systemtic Name: 1-[(6-chloranylpyridin-3-yl)methyl]-4-(phenylmethyl)piperazin-1-ium Openeye Name: 1-benzyl-4-[(6-chloro-3-pyridyl)methyl]piperazin-4-ium CAS Name: 1-[(6-chloro-3-pyridinyl)methyl]-4-(phenylmethyl)piperazin-1-ium IUPAC Name: 1-benzyl-4-[(6-chloropyridin-3-yl)methyl]piperazin-4-ium Traditional Name: 1-benzyl-4-[(6-chloro-3-pyridyl)methyl]piperazin-4-ium Formula: C17H21ClN3+ MolecularWeight: 302.82174

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CC2=CN=C(C=C2)Cl)CC3=CC=CC=C3

Isomeric SMILES

C1CN(CC[NH+]1CC2=CN=C(C=C2)Cl)CC3=CC=CC=C3

InChI

InChI=1S/C17H20ClN3/c18-17-7-6-16(12-19-17)14-21-10-8-20(9-11-21)13-15-4-2-1-3-5-15/h1-7,12H,8-11,13-14H2/p+1