3-[(3-bromophenyl)carbamoyl]-1-(2-methylpropyl)-4-oxidanylidene-5,6,7,8-tetrahydroquinolin-2-olate

Systemtic Name: 3-[(3-bromophenyl)carbamoyl]-1-(2-methylpropyl)-4-oxidanylidene-5,6,7,8-tetrahydroquinolin-2-olate Openeye Name: 3-[(3-bromophenyl)carbamoyl]-1-isobutyl-4-oxo-5,6,7,8-tetrahydroquinolin-2-olate CAS Name: 3-[(3-bromoanilino)-oxomethyl]-1-(2-methylpropyl)-4-oxo-5,6,7,8-tetrahydroquinolin-2-olate IUPAC Name: 3-[(3-bromophenyl)carbamoyl]-1-(2-methylpropyl)-4-oxo-5,6,7,8-tetrahydroquinolin-2-olate Traditional Name: 3-[(3-bromophenyl)carbamoyl]-1-isobutyl-4-keto-5,6,7,8-tetrahydroquinolin-2-olate Formula: C20H22BrN2O3- MolecularWeight: 418.30428

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN1C2=C(CCCC2)C(=O)C(=C1[O-])C(=O)NC3=CC(=CC=C3)Br

Isomeric SMILES

CC(C)CN1C2=C(CCCC2)C(=O)C(=C1[O-])C(=O)NC3=CC(=CC=C3)Br

InChI

InChI=1S/C20H23BrN2O3/c1-12(2)11-23-16-9-4-3-8-15(16)18(24)17(20(23)26)19(25)22-14-7-5-6-13(21)10-14/h5-7,10,12,26H,3-4,8-9,11H2,1-2H3,(H,22,25)/p-1