O3-ethyl O6-methyl 4-[[4-(3-methylbutoxycarbonyl)phenyl]amino]quinoline-3,6-dicarboxylate

Systemtic Name: O3-ethyl O6-methyl 4-[[4-(3-methylbutoxycarbonyl)phenyl]amino]quinoline-3,6-dicarboxylate Openeye Name: O3-ethyl O6-methyl 4-(4-isopentyloxycarbonylanilino)quinoline-3,6-dicarboxylate CAS Name: 4-[4-[3-methylbutoxy(oxo)methyl]anilino]quinoline-3,6-dicarboxylic acid O3-ethyl ester O6-methyl ester IUPAC Name: 3-O-ethyl 6-O-methyl 4-[4-(3-methylbutoxycarbonyl)anilino]quinoline-3,6-dicarboxylate Traditional Name: 4-(4-isoamoxycarbonylanilino)quinoline-3,6-dicarboxylic acid O3-ethyl ester O6-methyl ester Formula: C26H28N2O6 MolecularWeight: 464.51032

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CN=C2C=CC(=CC2=C1NC3=CC=C(C=C3)C(=O)OCCC(C)C)C(=O)OC

Isomeric SMILES

CCOC(=O)C1=CN=C2C=CC(=CC2=C1NC3=CC=C(C=C3)C(=O)OCCC(C)C)C(=O)OC

InChI

InChI=1S/C26H28N2O6/c1-5-33-26(31)21-15-27-22-11-8-18(24(29)32-4)14-20(22)23(21)28-19-9-6-17(7-10-19)25(30)34-13-12-16(2)3/h6-11,14-16H,5,12-13H2,1-4H3,(H,27,28)