6-(dimethylamino)-4-[(1,5-dimethyl-3-oxidanylidene-2-phenyl-pyrazol-4-yl)amino]quinoline-3-carboxylic acid

Systemtic Name: 6-(dimethylamino)-4-[(1,5-dimethyl-3-oxidanylidene-2-phenyl-pyrazol-4-yl)amino]quinoline-3-carboxylic acid Openeye Name: 6-(dimethylamino)-4-[(1,5-dimethyl-3-oxo-2-phenyl-pyrazol-4-yl)amino]quinoline-3-carboxylic acid CAS Name: 6-(dimethylamino)-4-[(1,5-dimethyl-3-oxo-2-phenyl-4-pyrazolyl)amino]-3-quinolinecarboxylic acid IUPAC Name: 6-(dimethylamino)-4-[(1,5-dimethyl-3-oxo-2-phenylpyrazol-4-yl)amino]quinoline-3-carboxylic acid Traditional Name: 6-(dimethylamino)-4-[(3-keto-1,5-dimethyl-2-phenyl-3-pyrazolin-4-yl)amino]quinoline-3-carboxylic acid Formula: C23H23N5O3 MolecularWeight: 417.46042

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)N(N1C)C2=CC=CC=C2)NC3=C4C=C(C=CC4=NC=C3C(=O)O)N(C)C

Isomeric SMILES

CC1=C(C(=O)N(N1C)C2=CC=CC=C2)NC3=C4C=C(C=CC4=NC=C3C(=O)O)N(C)C

InChI

InChI=1S/C23H23N5O3/c1-14-20(22(29)28(27(14)4)15-8-6-5-7-9-15)25-21-17-12-16(26(2)3)10-11-19(17)24-13-18(21)23(30)31/h5-13H,1-4H3,(H,24,25)(H,30,31)