O1-ethyl O4-[2-[(4-morpholin-4-ylsulfonylphenyl)amino]-2-oxidanylidene-ethyl] (E)-but-2-enedioate

Systemtic Name: O1-ethyl O4-[2-[(4-morpholin-4-ylsulfonylphenyl)amino]-2-oxidanylidene-ethyl] (E)-but-2-enedioate Openeye Name: O1-ethyl O4-[2-(4-morpholinosulfonylanilino)-2-oxo-ethyl] (E)-but-2-enedioate CAS Name: (E)-2-butenedioic acid O1-ethyl ester O4-[2-[4-(4-morpholinylsulfonyl)anilino]-2-oxoethyl] ester IUPAC Name: 1-O-ethyl 4-O-[2-(4-morpholin-4-ylsulfonylanilino)-2-oxoethyl] (E)-but-2-enedioate Traditional Name: (E)-but-2-enedioic acid O1-ethyl ester O4-[2-keto-2-(4-morpholinosulfonylanilino)ethyl] ester Formula: C18H22N2O8S MolecularWeight: 426.44088

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C=CC(=O)OCC(=O)NC1=CC=C(C=C1)S(=O)(=O)N2CCOCC2

Isomeric SMILES

CCOC(=O)/C=C/C(=O)OCC(=O)NC1=CC=C(C=C1)S(=O)(=O)N2CCOCC2

InChI

InChI=1S/C18H22N2O8S/c1-2-27-17(22)7-8-18(23)28-13-16(21)19-14-3-5-15(6-4-14)29(24,25)20-9-11-26-12-10-20/h3-8H,2,9-13H2,1H3,(H,19,21)/b8-7+