6-methoxy-2-(4-oxidanylpiperidin-1-yl)quinolin-1-ium-3-carbonitrile

Systemtic Name: 6-methoxy-2-(4-oxidanylpiperidin-1-yl)quinolin-1-ium-3-carbonitrile Openeye Name: 2-(4-hydroxy-1-piperidyl)-6-methoxy-quinolin-1-ium-3-carbonitrile CAS Name: 2-(4-hydroxy-1-piperidinyl)-6-methoxy-3-quinolin-1-iumcarbonitrile IUPAC Name: 2-(4-hydroxypiperidin-1-yl)-6-methoxyquinolin-1-ium-3-carbonitrile Traditional Name: 2-(4-hydroxypiperidino)-6-methoxy-quinolin-1-ium-3-carbonitrile Formula: C16H18N3O2+ MolecularWeight: 284.33302

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)[NH+]=C(C(=C2)C#N)N3CCC(CC3)O

Isomeric SMILES

COC1=CC2=C(C=C1)[NH+]=C(C(=C2)C#N)N3CCC(CC3)O

InChI

InChI=1S/C16H17N3O2/c1-21-14-2-3-15-11(9-14)8-12(10-17)16(18-15)19-6-4-13(20)5-7-19/h2-3,8-9,13,20H,4-7H2,1H3/p+1