5-[[4-(phenylmethyl)piperidin-1-ium-1-yl]methyl]quinolin-8-olate

Systemtic Name: 5-[[4-(phenylmethyl)piperidin-1-ium-1-yl]methyl]quinolin-8-olate Openeye Name: 5-[(4-benzylpiperidin-1-ium-1-yl)methyl]quinolin-8-olate CAS Name: 5-[[4-(phenylmethyl)-1-piperidin-1-iumyl]methyl]-8-quinolinolate IUPAC Name: 5-[(4-benzylpiperidin-1-ium-1-yl)methyl]quinolin-8-olate Traditional Name: 5-[(4-benzylpiperidin-1-ium-1-yl)methyl]quinolin-8-olate Formula: C22H24N2O MolecularWeight: 332.43876

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CCC1CC2=CC=CC=C2)CC3=C4C=CC=NC4=C(C=C3)[O-]

Isomeric SMILES

C1C[NH+](CCC1CC2=CC=CC=C2)CC3=C4C=CC=NC4=C(C=C3)[O-]

InChI

InChI=1S/C22H24N2O/c25-21-9-8-19(20-7-4-12-23-22(20)21)16-24-13-10-18(11-14-24)15-17-5-2-1-3-6-17/h1-9,12,18,25H,10-11,13-16H2