1-[(S)-(4-methoxyphenyl)-pyridin-2-yl-methyl]piperazin-4-ium

Systemtic Name: 1-[(S)-(4-methoxyphenyl)-pyridin-2-yl-methyl]piperazin-4-ium Openeye Name: 1-[(S)-(4-methoxyphenyl)-(2-pyridyl)methyl]piperazin-4-ium CAS Name: 1-[(S)-(4-methoxyphenyl)-(2-pyridinyl)methyl]piperazin-4-ium IUPAC Name: 1-[(S)-(4-methoxyphenyl)-pyridin-2-ylmethyl]piperazin-4-ium Traditional Name: 1-[(S)-(4-methoxyphenyl)-(2-pyridyl)methyl]piperazin-4-ium Formula: C17H22N3O+ MolecularWeight: 284.37608

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C(C2=CC=CC=N2)N3CC[NH2+]CC3

Isomeric SMILES

COC1=CC=C(C=C1)[C@@H](C2=CC=CC=N2)N3CC[NH2+]CC3

InChI

InChI=1S/C17H21N3O/c1-21-15-7-5-14(6-8-15)17(16-4-2-3-9-19-16)20-12-10-18-11-13-20/h2-9,17-18H,10-13H2,1H3/p+1/t17-/m0/s1