O1-ethyl O4-[2-[(2-ethyl-6-methyl-phenyl)amino]-2-oxidanylidene-ethyl] (E)-but-2-enedioate

Systemtic Name: O1-ethyl O4-[2-[(2-ethyl-6-methyl-phenyl)amino]-2-oxidanylidene-ethyl] (E)-but-2-enedioate Openeye Name: O1-ethyl O4-[2-(2-ethyl-6-methyl-anilino)-2-oxo-ethyl] (E)-but-2-enedioate CAS Name: (E)-2-butenedioic acid O1-ethyl ester O4-[2-(2-ethyl-6-methylanilino)-2-oxoethyl] ester IUPAC Name: 1-O-ethyl 4-O-[2-(2-ethyl-6-methylanilino)-2-oxoethyl] (E)-but-2-enedioate Traditional Name: (E)-but-2-enedioic acid O1-ethyl ester O4-[2-(2-ethyl-6-methyl-anilino)-2-keto-ethyl] ester Formula: C17H21NO5 MolecularWeight: 319.35234

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC(=C1NC(=O)COC(=O)C=CC(=O)OCC)C

Isomeric SMILES

CCC1=CC=CC(=C1NC(=O)COC(=O)/C=C/C(=O)OCC)C

InChI

InChI=1S/C17H21NO5/c1-4-13-8-6-7-12(3)17(13)18-14(19)11-23-16(21)10-9-15(20)22-5-2/h6-10H,4-5,11H2,1-3H3,(H,18,19)/b10-9+