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

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

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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