O3-ethyl O8-methyl 4-[[4-(3-methylbutoxy)phenyl]amino]quinoline-3,8-dicarboxylate

Systemtic Name: O3-ethyl O8-methyl 4-[[4-(3-methylbutoxy)phenyl]amino]quinoline-3,8-dicarboxylate Openeye Name: O3-ethyl O8-methyl 4-(4-isopentyloxyanilino)quinoline-3,8-dicarboxylate CAS Name: 4-[4-(3-methylbutoxy)anilino]quinoline-3,8-dicarboxylic acid O3-ethyl ester O8-methyl ester IUPAC Name: 3-O-ethyl 8-O-methyl 4-[4-(3-methylbutoxy)anilino]quinoline-3,8-dicarboxylate Traditional Name: 4-(4-isoamoxyanilino)quinoline-3,8-dicarboxylic acid O3-ethyl ester O8-methyl ester Formula: C25H28N2O5 MolecularWeight: 436.50022

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C25H28N2O5/c1-5-31-25(29)21-15-26-22-19(7-6-8-20(22)24(28)30-4)23(21)27-17-9-11-18(12-10-17)32-14-13-16(2)3/h6-12,15-16H,5,13-14H2,1-4H3,(H,26,27)