dimethyl (Z)-2-[[2-methoxycarbonyl-4-(2-methylpropoxy)quinolin-8-yl]amino]but-2-enedioate

Systemtic Name: dimethyl (Z)-2-[[2-methoxycarbonyl-4-(2-methylpropoxy)quinolin-8-yl]amino]but-2-enedioate Openeye Name: dimethyl (Z)-2-[(4-isobutoxy-2-methoxycarbonyl-8-quinolyl)amino]but-2-enedioate CAS Name: (Z)-2-[[2-methoxycarbonyl-4-(2-methylpropoxy)-8-quinolinyl]amino]-2-butenedioic acid dimethyl ester IUPAC Name: dimethyl (Z)-2-[[2-methoxycarbonyl-4-(2-methylpropoxy)quinolin-8-yl]amino]but-2-enedioate Traditional Name: (Z)-2-[(2-carbomethoxy-4-isobutoxy-8-quinolyl)amino]but-2-enedioic acid dimethyl ester Formula: C21H24N2O7 MolecularWeight: 416.42446

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)COC1=CC(=NC2=C1C=CC=C2NC(=CC(=O)OC)C(=O)OC)C(=O)OC

Isomeric SMILES

CC(C)COC1=CC(=NC2=C1C=CC=C2N/C(=C\C(=O)OC)/C(=O)OC)C(=O)OC

InChI

InChI=1S/C21H24N2O7/c1-12(2)11-30-17-9-15(20(25)28-4)23-19-13(17)7-6-8-14(19)22-16(21(26)29-5)10-18(24)27-3/h6-10,12,22H,11H2,1-5H3/b16-10-