3-[(2-cyanophenyl)carbamoyl]-1-(3-methylbutyl)-4-oxidanylidene-quinolin-2-olate

Systemtic Name: 3-[(2-cyanophenyl)carbamoyl]-1-(3-methylbutyl)-4-oxidanylidene-quinolin-2-olate Openeye Name: 3-[(2-cyanophenyl)carbamoyl]-1-isopentyl-4-oxo-quinolin-2-olate CAS Name: 3-[(2-cyanoanilino)-oxomethyl]-1-(3-methylbutyl)-4-oxo-2-quinolinolate IUPAC Name: 3-[(2-cyanophenyl)carbamoyl]-1-(3-methylbutyl)-4-oxoquinolin-2-olate Traditional Name: 3-[(2-cyanophenyl)carbamoyl]-1-isoamyl-4-keto-quinolin-2-olate Formula: C22H20N3O3- MolecularWeight: 374.4125

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCN1C2=CC=CC=C2C(=O)C(=C1[O-])C(=O)NC3=CC=CC=C3C#N

Isomeric SMILES

CC(C)CCN1C2=CC=CC=C2C(=O)C(=C1[O-])C(=O)NC3=CC=CC=C3C#N

InChI

InChI=1S/C22H21N3O3/c1-14(2)11-12-25-18-10-6-4-8-16(18)20(26)19(22(25)28)21(27)24-17-9-5-3-7-15(17)13-23/h3-10,14,28H,11-12H2,1-2H3,(H,24,27)/p-1