[4-[(3-butanoyl-8-methoxy-quinolin-4-yl)amino]-3-methyl-phenyl] 2-methylpropanoate

Systemtic Name: [4-[(3-butanoyl-8-methoxy-quinolin-4-yl)amino]-3-methyl-phenyl] 2-methylpropanoate Openeye Name: [4-[(3-butanoyl-8-methoxy-4-quinolyl)amino]-3-methyl-phenyl] 2-methylpropanoate CAS Name: 2-methylpropanoic acid [4-[[8-methoxy-3-(1-oxobutyl)-4-quinolinyl]amino]-3-methylphenyl] ester IUPAC Name: [4-[(3-butanoyl-8-methoxyquinolin-4-yl)amino]-3-methylphenyl] 2-methylpropanoate Traditional Name: 2-methylpropionic acid [4-[(3-butyryl-8-methoxy-4-quinolyl)amino]-3-methyl-phenyl] ester Formula: C25H28N2O4 MolecularWeight: 420.50082

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)C1=CN=C2C(=C1NC3=C(C=C(C=C3)OC(=O)C(C)C)C)C=CC=C2OC

Isomeric SMILES

CCCC(=O)C1=CN=C2C(=C1NC3=C(C=C(C=C3)OC(=O)C(C)C)C)C=CC=C2OC

InChI

InChI=1S/C25H28N2O4/c1-6-8-21(28)19-14-26-24-18(9-7-10-22(24)30-5)23(19)27-20-12-11-17(13-16(20)4)31-25(29)15(2)3/h7,9-15H,6,8H2,1-5H3,(H,26,27)