[7-azanyl-1-methyl-3-(3-methylbut-2-enoxy)-2-oxidanylidene-quinolin-4-yl] benzoate

Systemtic Name: [7-azanyl-1-methyl-3-(3-methylbut-2-enoxy)-2-oxidanylidene-quinolin-4-yl] benzoate Openeye Name: [7-amino-1-methyl-3-(3-methylbut-2-enoxy)-2-oxo-4-quinolyl] benzoate CAS Name: benzoic acid [7-amino-1-methyl-3-(3-methylbut-2-enoxy)-2-oxo-4-quinolinyl] ester IUPAC Name: [7-amino-1-methyl-3-(3-methylbut-2-enoxy)-2-oxoquinolin-4-yl] benzoate Traditional Name: benzoic acid [7-amino-2-keto-1-methyl-3-(3-methylbut-2-enoxy)-4-quinolyl] ester Formula: C22H22N2O4 MolecularWeight: 378.42108

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Descriptors Computed from Structure

Canonical SMILES:

CC(=CCOC1=C(C2=C(C=C(C=C2)N)N(C1=O)C)OC(=O)C3=CC=CC=C3)C

Isomeric SMILES

CC(=CCOC1=C(C2=C(C=C(C=C2)N)N(C1=O)C)OC(=O)C3=CC=CC=C3)C

InChI

InChI=1S/C22H22N2O4/c1-14(2)11-12-27-20-19(28-22(26)15-7-5-4-6-8-15)17-10-9-16(23)13-18(17)24(3)21(20)25/h4-11,13H,12,23H2,1-3H3