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

Systemtic Name: 2-methyl-3-(morpholin-4-ium-4-ylmethyl)-6-phenoxy-1H-quinolin-4-one Openeye Name: 2-methyl-3-(morpholin-4-ium-4-ylmethyl)-6-phenoxy-1H-quinolin-4-one CAS Name: 2-methyl-3-(4-morpholin-4-iumylmethyl)-6-phenoxy-1H-quinolin-4-one IUPAC Name: 2-methyl-3-(morpholin-4-ium-4-ylmethyl)-6-phenoxy-1H-quinolin-4-one Traditional Name: 2-methyl-3-(morpholin-4-ium-4-ylmethyl)-6-phenoxy-4-quinolone Formula: C21H23N2O3+ MolecularWeight: 351.41892

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)C2=C(N1)C=CC(=C2)OC3=CC=CC=C3)C[NH+]4CCOCC4

Isomeric SMILES

CC1=C(C(=O)C2=C(N1)C=CC(=C2)OC3=CC=CC=C3)C[NH+]4CCOCC4

InChI

InChI=1S/C21H22N2O3/c1-15-19(14-23-9-11-25-12-10-23)21(24)18-13-17(7-8-20(18)22-15)26-16-5-3-2-4-6-16/h2-8,13H,9-12,14H2,1H3,(H,22,24)/p+1