(E)-4,4-dimethyl-7-[2-[(E)-oct-1-enyl]cyclopentyl]-2-phenylmethoxy-hept-5-enoic acid

Systemtic Name: (E)-4,4-dimethyl-7-[2-[(E)-oct-1-enyl]cyclopentyl]-2-phenylmethoxy-hept-5-enoic acid Openeye Name: (E)-2-benzyloxy-4,4-dimethyl-7-[2-[(E)-oct-1-enyl]cyclopentyl]hept-5-enoic acid CAS Name: (E)-4,4-dimethyl-7-[2-[(E)-oct-1-enyl]cyclopentyl]-2-phenylmethoxy-5-heptenoic acid IUPAC Name: (E)-4,4-dimethyl-7-[2-[(E)-oct-1-enyl]cyclopentyl]-2-phenylmethoxyhept-5-enoic acid Traditional Name: (E)-2-benzoxy-4,4-dimethyl-7-[2-[(E)-oct-1-enyl]cyclopentyl]hept-5-enoic acid Formula: C29H44O3 MolecularWeight: 440.65786

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC=CC1CCCC1CC=CC(C)(C)CC(C(=O)O)OCC2=CC=CC=C2

Isomeric SMILES

CCCCCC/C=C/C1CCCC1C/C=C/C(C)(C)CC(C(=O)O)OCC2=CC=CC=C2

InChI

InChI=1S/C29H44O3/c1-4-5-6-7-8-12-17-25-18-13-19-26(25)20-14-21-29(2,3)22-27(28(30)31)32-23-24-15-10-9-11-16-24/h9-12,14-17,21,25-27H,4-8,13,18-20,22-23H2,1-3H3,(H,30,31)/b17-12+,21-14+