O4-[2-[(4-cyclopropyl-3-ethoxycarbonyl-thiophen-2-yl)amino]-2-oxidanylidene-ethyl] O1-ethyl (E)-but-2-enedioate

Systemtic Name: O4-[2-[(4-cyclopropyl-3-ethoxycarbonyl-thiophen-2-yl)amino]-2-oxidanylidene-ethyl] O1-ethyl (E)-but-2-enedioate Openeye Name: O4-[2-[(4-cyclopropyl-3-ethoxycarbonyl-2-thienyl)amino]-2-oxo-ethyl] O1-ethyl (E)-but-2-enedioate CAS Name: (E)-2-butenedioic acid O4-[2-[(4-cyclopropyl-3-ethoxycarbonyl-2-thiophenyl)amino]-2-oxoethyl] ester O1-ethyl ester IUPAC Name: 4-O-[2-[(4-cyclopropyl-3-ethoxycarbonylthiophen-2-yl)amino]-2-oxoethyl] 1-O-ethyl (E)-but-2-enedioate Traditional Name: (E)-but-2-enedioic acid O4-[2-[(3-carbethoxy-4-cyclopropyl-2-thienyl)amino]-2-keto-ethyl] ester O1-ethyl ester Formula: C18H21NO7S MolecularWeight: 395.42684

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C=CC(=O)OCC(=O)NC1=C(C(=CS1)C2CC2)C(=O)OCC

Isomeric SMILES

CCOC(=O)/C=C/C(=O)OCC(=O)NC1=C(C(=CS1)C2CC2)C(=O)OCC

InChI

InChI=1S/C18H21NO7S/c1-3-24-14(21)7-8-15(22)26-9-13(20)19-17-16(18(23)25-4-2)12(10-27-17)11-5-6-11/h7-8,10-11H,3-6,9H2,1-2H3,(H,19,20)/b8-7+