7-[(1S,2S,4S)-4-methyl-2-[(E)-oct-1-enyl]cyclopentyl]heptanoic acid

Systemtic Name: 7-[(1S,2S,4S)-4-methyl-2-[(E)-oct-1-enyl]cyclopentyl]heptanoic acid Openeye Name: 7-[(1S,2S,4S)-4-methyl-2-[(E)-oct-1-enyl]cyclopentyl]heptanoic acid CAS Name: 7-[(1S,2S,4S)-4-methyl-2-[(E)-oct-1-enyl]cyclopentyl]heptanoic acid IUPAC Name: 7-[(1S,2S,4S)-4-methyl-2-[(E)-oct-1-enyl]cyclopentyl]heptanoic acid Traditional Name: 7-[(1S,2S,4S)-4-methyl-2-[(E)-oct-1-enyl]cyclopentyl]enanthic acid Formula: C21H38O2 MolecularWeight: 322.52522

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC=CC1CC(CC1CCCCCCC(=O)O)C

Isomeric SMILES

CCCCCC/C=C/[C@H]1C[C@H](C[C@@H]1CCCCCCC(=O)O)C

InChI

InChI=1S/C21H38O2/c1-3-4-5-6-7-10-13-19-16-18(2)17-20(19)14-11-8-9-12-15-21(22)23/h10,13,18-20H,3-9,11-12,14-17H2,1-2H3,(H,22,23)/b13-10+/t18-,19+,20+/m1/s1