3-[(4-chloranyl-2-methoxy-phenyl)carbamoyl]-1-(3-methylbutyl)-4-oxidanylidene-quinolin-2-olate

Systemtic Name: 3-[(4-chloranyl-2-methoxy-phenyl)carbamoyl]-1-(3-methylbutyl)-4-oxidanylidene-quinolin-2-olate Openeye Name: 3-[(4-chloro-2-methoxy-phenyl)carbamoyl]-1-isopentyl-4-oxo-quinolin-2-olate CAS Name: 3-[(4-chloro-2-methoxyanilino)-oxomethyl]-1-(3-methylbutyl)-4-oxo-2-quinolinolate IUPAC Name: 3-[(4-chloro-2-methoxyphenyl)carbamoyl]-1-(3-methylbutyl)-4-oxoquinolin-2-olate Traditional Name: 3-[(4-chloro-2-methoxy-phenyl)carbamoyl]-1-isoamyl-4-keto-quinolin-2-olate Formula: C22H22ClN2O4- MolecularWeight: 413.87408

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCN1C2=CC=CC=C2C(=O)C(=C1[O-])C(=O)NC3=C(C=C(C=C3)Cl)OC

Isomeric SMILES

CC(C)CCN1C2=CC=CC=C2C(=O)C(=C1[O-])C(=O)NC3=C(C=C(C=C3)Cl)OC

InChI

InChI=1S/C22H23ClN2O4/c1-13(2)10-11-25-17-7-5-4-6-15(17)20(26)19(22(25)28)21(27)24-16-9-8-14(23)12-18(16)29-3/h4-9,12-13,28H,10-11H2,1-3H3,(H,24,27)/p-1