5-(2-but-3-enyl-1,3-dithian-2-yl)pentan-2-yl 2,4-dimethoxy-6-prop-2-enyl-benzoate

Systemtic Name: 5-(2-but-3-enyl-1,3-dithian-2-yl)pentan-2-yl 2,4-dimethoxy-6-prop-2-enyl-benzoate Openeye Name: [4-(2-but-3-enyl-1,3-dithian-2-yl)-1-methyl-butyl] 2-allyl-4,6-dimethoxy-benzoate CAS Name: 2,4-dimethoxy-6-prop-2-enylbenzoic acid 5-(2-but-3-enyl-1,3-dithian-2-yl)pentan-2-yl ester IUPAC Name: 5-(2-but-3-enyl-1,3-dithian-2-yl)pentan-2-yl 2,4-dimethoxy-6-prop-2-enylbenzoate Traditional Name: 2-allyl-4,6-dimethoxy-benzoic acid [4-(2-but-3-enyl-1,3-dithian-2-yl)-1-methyl-butyl] ester Formula: C25H36O4S2 MolecularWeight: 464.68094

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Descriptors Computed from Structure

Canonical SMILES:

CC(CCCC1(SCCCS1)CCC=C)OC(=O)C2=C(C=C(C=C2CC=C)OC)OC

Isomeric SMILES

CC(CCCC1(SCCCS1)CCC=C)OC(=O)C2=C(C=C(C=C2CC=C)OC)OC

InChI

InChI=1S/C25H36O4S2/c1-6-8-13-25(30-15-10-16-31-25)14-9-12-19(3)29-24(26)23-20(11-7-2)17-21(27-4)18-22(23)28-5/h6-7,17-19H,1-2,8-16H2,3-5H3