O1-ethyl O4-(3-sulfanylpropyl) (E)-but-2-enedioate

Systemtic Name: O1-ethyl O4-(3-sulfanylpropyl) (E)-but-2-enedioate Openeye Name: O1-ethyl O4-(3-sulfanylpropyl) (E)-but-2-enedioate CAS Name: (E)-2-butenedioic acid O1-ethyl ester O4-(3-mercaptopropyl) ester IUPAC Name: 1-O-ethyl 4-O-(3-sulfanylpropyl) (E)-but-2-enedioate Traditional Name: (E)-but-2-enedioic acid O1-ethyl ester O4-(3-mercaptopropyl) ester Formula: C9H14O4S MolecularWeight: 218.27006

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C=CC(=O)OCCCS

Isomeric SMILES

CCOC(=O)/C=C/C(=O)OCCCS

InChI

InChI=1S/C9H14O4S/c1-2-12-8(10)4-5-9(11)13-6-3-7-14/h4-5,14H,2-3,6-7H2,1H3/b5-4+