1-methyl-3-(5-methyl-1-phenyl-pyrazol-3-yl)-2-oxidanyl-3H-quinolin-1-ium-4-one

Systemtic Name: 1-methyl-3-(5-methyl-1-phenyl-pyrazol-3-yl)-2-oxidanyl-3H-quinolin-1-ium-4-one Openeye Name: 2-hydroxy-1-methyl-3-(5-methyl-1-phenyl-pyrazol-3-yl)-3H-quinolin-1-ium-4-one CAS Name: 2-hydroxy-1-methyl-3-(5-methyl-1-phenyl-3-pyrazolyl)-3H-quinolin-1-ium-4-one IUPAC Name: 2-hydroxy-1-methyl-3-(5-methyl-1-phenylpyrazol-3-yl)-3H-quinolin-1-ium-4-one Traditional Name: 2-hydroxy-1-methyl-3-(5-methyl-1-phenyl-pyrazol-3-yl)-3H-quinolin-1-ium-4-one Formula: C20H18N3O2+ MolecularWeight: 332.37582

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NN1C2=CC=CC=C2)C3C(=O)C4=CC=CC=C4[N+](=C3O)C

Isomeric SMILES

CC1=CC(=NN1C2=CC=CC=C2)C3C(=O)C4=CC=CC=C4[N+](=C3O)C

InChI

InChI=1S/C20H17N3O2/c1-13-12-16(21-23(13)14-8-4-3-5-9-14)18-19(24)15-10-6-7-11-17(15)22(2)20(18)25/h3-12,18H,1-2H3/p+1