dimethyl (3aS,6R,7aR)-6-acetyloxy-3-hex-1-en-2-yl-3a,6,7,7a-tetrahydroindene-1,1-dicarboxylate

Systemtic Name: dimethyl (3aS,6R,7aR)-6-acetyloxy-3-hex-1-en-2-yl-3a,6,7,7a-tetrahydroindene-1,1-dicarboxylate Openeye Name: dimethyl (3aS,6R,7aR)-6-acetoxy-3-(1-methylenepentyl)-3a,6,7,7a-tetrahydroindene-1,1-dicarboxylate CAS Name: (3aS,6R,7aR)-6-acetyloxy-3-hex-1-en-2-yl-3a,6,7,7a-tetrahydroindene-1,1-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl (3aS,6R,7aR)-6-acetyloxy-3-hex-1-en-2-yl-3a,6,7,7a-tetrahydroindene-1,1-dicarboxylate Traditional Name: (3aS,6R,7aR)-6-acetoxy-3-(1-butylvinyl)-3a,6,7,7a-tetrahydroindene-1,1-dicarboxylic acid dimethyl ester Formula: C21H28O6 MolecularWeight: 376.44342

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCC(=C)C1=CC(C2C1C=CC(C2)OC(=O)C)(C(=O)OC)C(=O)OC

Isomeric SMILES

CCCCC(=C)C1=CC([C@H]2[C@@H]1C=C[C@@H](C2)OC(=O)C)(C(=O)OC)C(=O)OC

InChI

InChI=1S/C21H28O6/c1-6-7-8-13(2)17-12-21(19(23)25-4,20(24)26-5)18-11-15(27-14(3)22)9-10-16(17)18/h9-10,12,15-16,18H,2,6-8,11H2,1,3-5H3/t15-,16+,18+/m0/s1