[1-methyl-3-[5-methyl-1-(phenylcarbonyl)pyrazol-3-yl]-2-oxidanylidene-quinolin-4-yl] benzoate

Systemtic Name: [1-methyl-3-[5-methyl-1-(phenylcarbonyl)pyrazol-3-yl]-2-oxidanylidene-quinolin-4-yl] benzoate Openeye Name: [3-(1-benzoyl-5-methyl-pyrazol-3-yl)-1-methyl-2-oxo-4-quinolyl] benzoate CAS Name: benzoic acid [3-(1-benzoyl-5-methyl-3-pyrazolyl)-1-methyl-2-oxo-4-quinolinyl] ester IUPAC Name: [3-(1-benzoyl-5-methylpyrazol-3-yl)-1-methyl-2-oxoquinolin-4-yl] benzoate Traditional Name: benzoic acid [3-(1-benzoyl-5-methyl-pyrazol-3-yl)-2-keto-1-methyl-4-quinolyl] ester Formula: C28H21N3O4 MolecularWeight: 463.48404

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NN1C(=O)C2=CC=CC=C2)C3=C(C4=CC=CC=C4N(C3=O)C)OC(=O)C5=CC=CC=C5

Isomeric SMILES

CC1=CC(=NN1C(=O)C2=CC=CC=C2)C3=C(C4=CC=CC=C4N(C3=O)C)OC(=O)C5=CC=CC=C5

InChI

InChI=1S/C28H21N3O4/c1-18-17-22(29-31(18)26(32)19-11-5-3-6-12-19)24-25(35-28(34)20-13-7-4-8-14-20)21-15-9-10-16-23(21)30(2)27(24)33/h3-17H,1-2H3