1-[6-(4-methoxy-3-methyl-phenyl)pyridin-2-yl]piperazin-4-ium

Systemtic Name: 1-[6-(4-methoxy-3-methyl-phenyl)pyridin-2-yl]piperazin-4-ium Openeye Name: 1-[6-(4-methoxy-3-methyl-phenyl)-2-pyridyl]piperazin-4-ium CAS Name: 1-[6-(4-methoxy-3-methylphenyl)-2-pyridinyl]piperazin-4-ium IUPAC Name: 1-[6-(4-methoxy-3-methylphenyl)pyridin-2-yl]piperazin-4-ium Traditional Name: 1-[6-(4-methoxy-3-methyl-phenyl)-2-pyridyl]piperazin-4-ium Formula: C17H22N3O+ MolecularWeight: 284.37608

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)C2=NC(=CC=C2)N3CC[NH2+]CC3)OC

Isomeric SMILES

CC1=C(C=CC(=C1)C2=NC(=CC=C2)N3CC[NH2+]CC3)OC

InChI

InChI=1S/C17H21N3O/c1-13-12-14(6-7-16(13)21-2)15-4-3-5-17(19-15)20-10-8-18-9-11-20/h3-7,12,18H,8-11H2,1-2H3/p+1