3-(1H-benzimidazol-2-ylcarbamoyl)-1-(2-methylpropyl)-4-oxidanylidene-quinolin-2-olate

Systemtic Name: 3-(1H-benzimidazol-2-ylcarbamoyl)-1-(2-methylpropyl)-4-oxidanylidene-quinolin-2-olate Openeye Name: 3-(1H-benzimidazol-2-ylcarbamoyl)-1-isobutyl-4-oxo-quinolin-2-olate CAS Name: 3-[(1H-benzimidazol-2-ylamino)-oxomethyl]-1-(2-methylpropyl)-4-oxo-2-quinolinolate IUPAC Name: 3-(1H-benzimidazol-2-ylcarbamoyl)-1-(2-methylpropyl)-4-oxoquinolin-2-olate Traditional Name: 3-(1H-benzimidazol-2-ylcarbamoyl)-1-isobutyl-4-keto-quinolin-2-olate Formula: C21H19N4O3- MolecularWeight: 375.40056

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN1C2=CC=CC=C2C(=O)C(=C1[O-])C(=O)NC3=NC4=CC=CC=C4N3

Isomeric SMILES

CC(C)CN1C2=CC=CC=C2C(=O)C(=C1[O-])C(=O)NC3=NC4=CC=CC=C4N3

InChI

InChI=1S/C21H20N4O3/c1-12(2)11-25-16-10-6-3-7-13(16)18(26)17(20(25)28)19(27)24-21-22-14-8-4-5-9-15(14)23-21/h3-10,12,28H,11H2,1-2H3,(H2,22,23,24,27)/p-1