methyl (E)-5-(2-butyl-1,3-dithian-2-yl)-4-oxidanylidene-pent-2-enoate

Systemtic Name: methyl (E)-5-(2-butyl-1,3-dithian-2-yl)-4-oxidanylidene-pent-2-enoate Openeye Name: methyl (E)-5-(2-butyl-1,3-dithian-2-yl)-4-oxo-pent-2-enoate CAS Name: (E)-5-(2-butyl-1,3-dithian-2-yl)-4-oxo-2-pentenoic acid methyl ester IUPAC Name: methyl (E)-5-(2-butyl-1,3-dithian-2-yl)-4-oxopent-2-enoate Traditional Name: (E)-5-(2-butyl-1,3-dithian-2-yl)-4-keto-pent-2-enoic acid methyl ester Formula: C14H22O3S2 MolecularWeight: 302.45268

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1(SCCCS1)CC(=O)C=CC(=O)OC

Isomeric SMILES

CCCCC1(SCCCS1)CC(=O)/C=C/C(=O)OC

InChI

InChI=1S/C14H22O3S2/c1-3-4-8-14(18-9-5-10-19-14)11-12(15)6-7-13(16)17-2/h6-7H,3-5,8-11H2,1-2H3/b7-6+