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

Systemtic Name: 2-methyl-6-phenylmethoxy-3-(piperidin-1-ium-1-ylmethyl)-1H-quinolin-4-one Openeye Name: 6-benzyloxy-2-methyl-3-(piperidin-1-ium-1-ylmethyl)-1H-quinolin-4-one CAS Name: 2-methyl-6-phenylmethoxy-3-(1-piperidin-1-iumylmethyl)-1H-quinolin-4-one IUPAC Name: 2-methyl-6-phenylmethoxy-3-(piperidin-1-ium-1-ylmethyl)-1H-quinolin-4-one Traditional Name: 6-benzoxy-2-methyl-3-(piperidin-1-ium-1-ylmethyl)-4-quinolone Formula: C23H27N2O2+ MolecularWeight: 363.47268

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)C2=C(N1)C=CC(=C2)OCC3=CC=CC=C3)C[NH+]4CCCCC4

Isomeric SMILES

CC1=C(C(=O)C2=C(N1)C=CC(=C2)OCC3=CC=CC=C3)C[NH+]4CCCCC4

InChI

InChI=1S/C23H26N2O2/c1-17-21(15-25-12-6-3-7-13-25)23(26)20-14-19(10-11-22(20)24-17)27-16-18-8-4-2-5-9-18/h2,4-5,8-11,14H,3,6-7,12-13,15-16H2,1H3,(H,24,26)/p+1