3-[(3,5-dimethylphenyl)carbamoyl]-4-oxidanylidene-1-pentyl-quinolin-2-olate

Systemtic Name: 3-[(3,5-dimethylphenyl)carbamoyl]-4-oxidanylidene-1-pentyl-quinolin-2-olate Openeye Name: 3-[(3,5-dimethylphenyl)carbamoyl]-4-oxo-1-pentyl-quinolin-2-olate CAS Name: 3-[(3,5-dimethylanilino)-oxomethyl]-4-oxo-1-pentyl-2-quinolinolate IUPAC Name: 3-[(3,5-dimethylphenyl)carbamoyl]-4-oxo-1-pentylquinolin-2-olate Traditional Name: 1-amyl-3-[(3,5-dimethylphenyl)carbamoyl]-4-keto-quinolin-2-olate Formula: C23H25N2O3- MolecularWeight: 377.4562

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCN1C2=CC=CC=C2C(=O)C(=C1[O-])C(=O)NC3=CC(=CC(=C3)C)C

Isomeric SMILES

CCCCCN1C2=CC=CC=C2C(=O)C(=C1[O-])C(=O)NC3=CC(=CC(=C3)C)C

InChI

InChI=1S/C23H26N2O3/c1-4-5-8-11-25-19-10-7-6-9-18(19)21(26)20(23(25)28)22(27)24-17-13-15(2)12-16(3)14-17/h6-7,9-10,12-14,28H,4-5,8,11H2,1-3H3,(H,24,27)/p-1