2-methyl-6-phenoxy-3-(piperidin-1-ium-1-ylmethyl)-1H-quinolin-4-one

Systemtic Name: 2-methyl-6-phenoxy-3-(piperidin-1-ium-1-ylmethyl)-1H-quinolin-4-one Openeye Name: 2-methyl-6-phenoxy-3-(piperidin-1-ium-1-ylmethyl)-1H-quinolin-4-one CAS Name: 2-methyl-6-phenoxy-3-(1-piperidin-1-iumylmethyl)-1H-quinolin-4-one IUPAC Name: 2-methyl-6-phenoxy-3-(piperidin-1-ium-1-ylmethyl)-1H-quinolin-4-one Traditional Name: 2-methyl-6-phenoxy-3-(piperidin-1-ium-1-ylmethyl)-4-quinolone Formula: C22H25N2O2+ MolecularWeight: 349.4461

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)C2=C(N1)C=CC(=C2)OC3=CC=CC=C3)C[NH+]4CCCCC4

Isomeric SMILES

CC1=C(C(=O)C2=C(N1)C=CC(=C2)OC3=CC=CC=C3)C[NH+]4CCCCC4

InChI

InChI=1S/C22H24N2O2/c1-16-20(15-24-12-6-3-7-13-24)22(25)19-14-18(10-11-21(19)23-16)26-17-8-4-2-5-9-17/h2,4-5,8-11,14H,3,6-7,12-13,15H2,1H3,(H,23,25)/p+1