O4-[2-(6-ethoxy-2,2,4-trimethyl-quinolin-1-yl)-2-oxidanylidene-ethyl] O1-ethyl (E)-but-2-enedioate

Systemtic Name: O4-[2-(6-ethoxy-2,2,4-trimethyl-quinolin-1-yl)-2-oxidanylidene-ethyl] O1-ethyl (E)-but-2-enedioate Openeye Name: O4-[2-(6-ethoxy-2,2,4-trimethyl-1-quinolyl)-2-oxo-ethyl] O1-ethyl (E)-but-2-enedioate CAS Name: (E)-2-butenedioic acid O4-[2-(6-ethoxy-2,2,4-trimethyl-1-quinolinyl)-2-oxoethyl] ester O1-ethyl ester IUPAC Name: 4-O-[2-(6-ethoxy-2,2,4-trimethylquinolin-1-yl)-2-oxoethyl] 1-O-ethyl (E)-but-2-enedioate Traditional Name: (E)-but-2-enedioic acid O4-[2-(6-ethoxy-2,2,4-trimethyl-1-quinolyl)-2-keto-ethyl] ester O1-ethyl ester Formula: C22H27NO6 MolecularWeight: 401.45288

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC2=C(C=C1)N(C(C=C2C)(C)C)C(=O)COC(=O)C=CC(=O)OCC

Isomeric SMILES

CCOC1=CC2=C(C=C1)N(C(C=C2C)(C)C)C(=O)COC(=O)/C=C/C(=O)OCC

InChI

InChI=1S/C22H27NO6/c1-6-27-16-8-9-18-17(12-16)15(3)13-22(4,5)23(18)19(24)14-29-21(26)11-10-20(25)28-7-2/h8-13H,6-7,14H2,1-5H3/b11-10+