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

Systemtic Name: 3-[(3,5-dimethylphenyl)carbamoyl]-4-oxidanylidene-1-prop-2-enyl-quinolin-2-olate Openeye Name: 1-allyl-3-[(3,5-dimethylphenyl)carbamoyl]-4-oxo-quinolin-2-olate CAS Name: 3-[(3,5-dimethylanilino)-oxomethyl]-4-oxo-1-prop-2-enyl-2-quinolinolate IUPAC Name: 3-[(3,5-dimethylphenyl)carbamoyl]-4-oxo-1-prop-2-enylquinolin-2-olate Traditional Name: 1-allyl-3-[(3,5-dimethylphenyl)carbamoyl]-4-keto-quinolin-2-olate Formula: C21H19N2O3- MolecularWeight: 347.38716

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)NC(=O)C2=C(N(C3=CC=CC=C3C2=O)CC=C)[O-])C

Isomeric SMILES

CC1=CC(=CC(=C1)NC(=O)C2=C(N(C3=CC=CC=C3C2=O)CC=C)[O-])C

InChI

InChI=1S/C21H20N2O3/c1-4-9-23-17-8-6-5-7-16(17)19(24)18(21(23)26)20(25)22-15-11-13(2)10-14(3)12-15/h4-8,10-12,26H,1,9H2,2-3H3,(H,22,25)/p-1