cyclopentyl (E)-2-[(E)-but-1-enyl]-4-(1-ethylcyclobutyl)-4-oxidanyl-hept-5-enoate

Systemtic Name: cyclopentyl (E)-2-[(E)-but-1-enyl]-4-(1-ethylcyclobutyl)-4-oxidanyl-hept-5-enoate Openeye Name: cyclopentyl (E)-2-[(E)-but-1-enyl]-4-(1-ethylcyclobutyl)-4-hydroxy-hept-5-enoate CAS Name: (E)-2-[(E)-but-1-enyl]-4-(1-ethylcyclobutyl)-4-hydroxy-5-heptenoic acid cyclopentyl ester IUPAC Name: cyclopentyl (E)-2-[(E)-but-1-enyl]-4-(1-ethylcyclobutyl)-4-hydroxyhept-5-enoate Traditional Name: (E)-2-[(E)-but-1-enyl]-4-(1-ethylcyclobutyl)-4-hydroxy-hept-5-enoic acid cyclopentyl ester Formula: C22H36O3 MolecularWeight: 348.51944

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Descriptors Computed from Structure

Canonical SMILES:

CCC=CC(CC(C=CC)(C1(CCC1)CC)O)C(=O)OC2CCCC2

Isomeric SMILES

CC/C=C/C(CC(/C=C/C)(C1(CCC1)CC)O)C(=O)OC2CCCC2

InChI

InChI=1S/C22H36O3/c1-4-7-11-18(20(23)25-19-12-8-9-13-19)17-22(24,14-5-2)21(6-3)15-10-16-21/h5,7,11,14,18-19,24H,4,6,8-10,12-13,15-17H2,1-3H3/b11-7+,14-5+