5-(imidazol-1-ylmethyl)-7-[(4-methylpiperidin-1-ium-1-yl)methyl]quinolin-8-ol

Systemtic Name: 5-(imidazol-1-ylmethyl)-7-[(4-methylpiperidin-1-ium-1-yl)methyl]quinolin-8-ol Openeye Name: 5-(imidazol-1-ylmethyl)-7-[(4-methylpiperidin-1-ium-1-yl)methyl]quinolin-8-ol CAS Name: 5-(1-imidazolylmethyl)-7-[(4-methyl-1-piperidin-1-iumyl)methyl]-8-quinolinol IUPAC Name: 5-(imidazol-1-ylmethyl)-7-[(4-methylpiperidin-1-ium-1-yl)methyl]quinolin-8-ol Traditional Name: 5-(imidazol-1-ylmethyl)-7-[(4-methylpiperidin-1-ium-1-yl)methyl]quinolin-8-ol Formula: C20H25N4O+ MolecularWeight: 337.4387

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC[NH+](CC1)CC2=C(C3=C(C=CC=N3)C(=C2)CN4C=CN=C4)O

Isomeric SMILES

CC1CC[NH+](CC1)CC2=C(C3=C(C=CC=N3)C(=C2)CN4C=CN=C4)O

InChI

InChI=1S/C20H24N4O/c1-15-4-8-23(9-5-15)13-17-11-16(12-24-10-7-21-14-24)18-3-2-6-22-19(18)20(17)25/h2-3,6-7,10-11,14-15,25H,4-5,8-9,12-13H2,1H3/p+1