1-(3-methylbutyl)-3-[(6-methylpyridin-2-yl)carbamoyl]-4-oxidanylidene-quinolin-2-olate

Systemtic Name: 1-(3-methylbutyl)-3-[(6-methylpyridin-2-yl)carbamoyl]-4-oxidanylidene-quinolin-2-olate Openeye Name: 1-isopentyl-3-[(6-methyl-2-pyridyl)carbamoyl]-4-oxo-quinolin-2-olate CAS Name: 1-(3-methylbutyl)-3-[[(6-methyl-2-pyridinyl)amino]-oxomethyl]-4-oxo-2-quinolinolate IUPAC Name: 1-(3-methylbutyl)-3-[(6-methylpyridin-2-yl)carbamoyl]-4-oxoquinolin-2-olate Traditional Name: 1-isoamyl-4-keto-3-[(6-methyl-2-pyridyl)carbamoyl]quinolin-2-olate Formula: C21H22N3O3- MolecularWeight: 364.41768

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H23N3O3/c1-13(2)11-12-24-16-9-5-4-8-15(16)19(25)18(21(24)27)20(26)23-17-10-6-7-14(3)22-17/h4-10,13,27H,11-12H2,1-3H3,(H,22,23,26)/p-1