methyl (E)-6-acetyloxy-8-(3-pentyl-3a,4,7,7a-tetrahydro-1H-inden-2-yl)oct-7-enoate

Systemtic Name: methyl (E)-6-acetyloxy-8-(3-pentyl-3a,4,7,7a-tetrahydro-1H-inden-2-yl)oct-7-enoate Openeye Name: methyl (E)-6-acetoxy-8-(3-pentyl-3a,4,7,7a-tetrahydro-1H-inden-2-yl)oct-7-enoate CAS Name: (E)-6-acetyloxy-8-(3-pentyl-3a,4,7,7a-tetrahydro-1H-inden-2-yl)-7-octenoic acid methyl ester IUPAC Name: methyl (E)-6-acetyloxy-8-(3-pentyl-3a,4,7,7a-tetrahydro-1H-inden-2-yl)oct-7-enoate Traditional Name: (E)-6-acetoxy-8-(3-amyl-3a,4,7,7a-tetrahydro-1H-inden-2-yl)oct-7-enoic acid methyl ester Formula: C25H38O4 MolecularWeight: 402.56682

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1=C(CC2C1CC=CC2)C=CC(CCCCC(=O)OC)OC(=O)C

Isomeric SMILES

CCCCCC1=C(CC2C1CC=CC2)/C=C/C(CCCCC(=O)OC)OC(=O)C

InChI

InChI=1S/C25H38O4/c1-4-5-6-13-24-21(18-20-11-7-9-14-23(20)24)16-17-22(29-19(2)26)12-8-10-15-25(27)28-3/h7,9,16-17,20,22-23H,4-6,8,10-15,18H2,1-3H3/b17-16+