O4-[2-(4-benzamidophenyl)-2-oxidanylidene-ethyl] O1-ethyl (E)-but-2-enedioate

Systemtic Name: O4-[2-(4-benzamidophenyl)-2-oxidanylidene-ethyl] O1-ethyl (E)-but-2-enedioate Openeye Name: O4-[2-(4-benzamidophenyl)-2-oxo-ethyl] O1-ethyl (E)-but-2-enedioate CAS Name: (E)-2-butenedioic acid O4-[2-(4-benzamidophenyl)-2-oxoethyl] ester O1-ethyl ester IUPAC Name: 4-O-[2-(4-benzamidophenyl)-2-oxoethyl] 1-O-ethyl (E)-but-2-enedioate Traditional Name: (E)-but-2-enedioic acid O4-[2-(4-benzamidophenyl)-2-keto-ethyl] ester O1-ethyl ester Formula: C21H19NO6 MolecularWeight: 381.37866

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C=CC(=O)OCC(=O)C1=CC=C(C=C1)NC(=O)C2=CC=CC=C2

Isomeric SMILES

CCOC(=O)/C=C/C(=O)OCC(=O)C1=CC=C(C=C1)NC(=O)C2=CC=CC=C2

InChI

InChI=1S/C21H19NO6/c1-2-27-19(24)12-13-20(25)28-14-18(23)15-8-10-17(11-9-15)22-21(26)16-6-4-3-5-7-16/h3-13H,2,14H2,1H3,(H,22,26)/b13-12+