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

Systemtic Name: methyl (E)-6-oxidanyl-8-(3-pentyl-3a,4,7,7a-tetrahydro-1H-inden-2-yl)oct-7-enoate Openeye Name: methyl (E)-6-hydroxy-8-(3-pentyl-3a,4,7,7a-tetrahydro-1H-inden-2-yl)oct-7-enoate CAS Name: (E)-6-hydroxy-8-(3-pentyl-3a,4,7,7a-tetrahydro-1H-inden-2-yl)-7-octenoic acid methyl ester IUPAC Name: methyl (E)-6-hydroxy-8-(3-pentyl-3a,4,7,7a-tetrahydro-1H-inden-2-yl)oct-7-enoate Traditional Name: (E)-8-(3-amyl-3a,4,7,7a-tetrahydro-1H-inden-2-yl)-6-hydroxy-oct-7-enoic acid methyl ester Formula: C23H36O3 MolecularWeight: 360.53014

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H36O3/c1-3-4-5-12-22-19(17-18-10-6-8-13-21(18)22)15-16-20(24)11-7-9-14-23(25)26-2/h6,8,15-16,18,20-21,24H,3-5,7,9-14,17H2,1-2H3/b16-15+