(2S)-2-(4-methoxyphenyl)-3-phenyl-1,2-dihydropyrimido[4,5-b]quinolin-10-ium-4-one

Systemtic Name: (2S)-2-(4-methoxyphenyl)-3-phenyl-1,2-dihydropyrimido[4,5-b]quinolin-10-ium-4-one Openeye Name: (2S)-2-(4-methoxyphenyl)-3-phenyl-1,2-dihydropyrimido[4,5-b]quinolin-10-ium-4-one CAS Name: (2S)-2-(4-methoxyphenyl)-3-phenyl-1,2-dihydropyrimido[4,5-b]quinolin-10-ium-4-one IUPAC Name: (2S)-2-(4-methoxyphenyl)-3-phenyl-1,2-dihydropyrimido[4,5-b]quinolin-10-ium-4-one Traditional Name: (2S)-2-(4-methoxyphenyl)-3-phenyl-1,2-dihydropyrimido[4,5-b]quinolin-10-ium-4-one Formula: C24H20N3O2+ MolecularWeight: 382.4345

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2NC3=[NH+]C4=CC=CC=C4C=C3C(=O)N2C5=CC=CC=C5

Isomeric SMILES

COC1=CC=C(C=C1)[C@H]2NC3=[NH+]C4=CC=CC=C4C=C3C(=O)N2C5=CC=CC=C5

InChI

InChI=1S/C24H19N3O2/c1-29-19-13-11-16(12-14-19)23-26-22-20(15-17-7-5-6-10-21(17)25-22)24(28)27(23)18-8-3-2-4-9-18/h2-15,23H,1H3,(H,25,26)/p+1/t23-/m0/s1