(2,5-dimethyl-1,3-benzodithiol-2-yl)methyl but-3-enoate

Systemtic Name: (2,5-dimethyl-1,3-benzodithiol-2-yl)methyl but-3-enoate Openeye Name: (2,5-dimethyl-1,3-benzodithiol-2-yl)methyl but-3-enoate CAS Name: 3-butenoic acid (2,5-dimethyl-1,3-benzodithiol-2-yl)methyl ester IUPAC Name: (2,5-dimethyl-1,3-benzodithiol-2-yl)methyl but-3-enoate Traditional Name: but-3-enoic acid (2,5-dimethyl-1,3-benzodithiol-2-yl)methyl ester Formula: C14H16O2S2 MolecularWeight: 280.40564

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)SC(S2)(C)COC(=O)CC=C

Isomeric SMILES

CC1=CC2=C(C=C1)SC(S2)(C)COC(=O)CC=C

InChI

InChI=1S/C14H16O2S2/c1-4-5-13(15)16-9-14(3)17-11-7-6-10(2)8-12(11)18-14/h4,6-8H,1,5,9H2,2-3H3