3-[(1,5-dimethyl-3-oxidanylidene-2-phenyl-pyrazol-4-yl)carbamoyl]-1-hexyl-4-oxidanylidene-quinolin-2-olate

Systemtic Name: 3-[(1,5-dimethyl-3-oxidanylidene-2-phenyl-pyrazol-4-yl)carbamoyl]-1-hexyl-4-oxidanylidene-quinolin-2-olate Openeye Name: 3-[(1,5-dimethyl-3-oxo-2-phenyl-pyrazol-4-yl)carbamoyl]-1-hexyl-4-oxo-quinolin-2-olate CAS Name: 3-[[(1,5-dimethyl-3-oxo-2-phenyl-4-pyrazolyl)amino]-oxomethyl]-1-hexyl-4-oxo-2-quinolinolate IUPAC Name: 3-[(1,5-dimethyl-3-oxo-2-phenylpyrazol-4-yl)carbamoyl]-1-hexyl-4-oxoquinolin-2-olate Traditional Name: 1-hexyl-4-keto-3-[(3-keto-1,5-dimethyl-2-phenyl-3-pyrazolin-4-yl)carbamoyl]quinolin-2-olate Formula: C27H29N4O4- MolecularWeight: 473.54356

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCN1C2=CC=CC=C2C(=O)C(=C1[O-])C(=O)NC3=C(N(N(C3=O)C4=CC=CC=C4)C)C

Isomeric SMILES

CCCCCCN1C2=CC=CC=C2C(=O)C(=C1[O-])C(=O)NC3=C(N(N(C3=O)C4=CC=CC=C4)C)C

InChI

InChI=1S/C27H30N4O4/c1-4-5-6-12-17-30-21-16-11-10-15-20(21)24(32)22(26(30)34)25(33)28-23-18(2)29(3)31(27(23)35)19-13-8-7-9-14-19/h7-11,13-16,34H,4-6,12,17H2,1-3H3,(H,28,33)/p-1