(E)-7-[(1R,2S)-2-(4-methyloct-1-ynyl)cyclopentyl]hept-5-enoic acid

Systemtic Name: (E)-7-[(1R,2S)-2-(4-methyloct-1-ynyl)cyclopentyl]hept-5-enoic acid Openeye Name: (E)-7-[(1R,2S)-2-(4-methyloct-1-ynyl)cyclopentyl]hept-5-enoic acid CAS Name: (E)-7-[(1R,2S)-2-(4-methyloct-1-ynyl)cyclopentyl]-5-heptenoic acid IUPAC Name: (E)-7-[(1R,2S)-2-(4-methyloct-1-ynyl)cyclopentyl]hept-5-enoic acid Traditional Name: (E)-7-[(1R,2S)-2-(4-methyloct-1-ynyl)cyclopentyl]hept-5-enoic acid Formula: C21H34O2 MolecularWeight: 318.49346

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(C)CC#CC1CCCC1CC=CCCCC(=O)O

Isomeric SMILES

CCCCC(C)CC#C[C@H]1CCC[C@@H]1C/C=C/CCCC(=O)O

InChI

InChI=1S/C21H34O2/c1-3-4-11-18(2)12-9-14-20-16-10-15-19(20)13-7-5-6-8-17-21(22)23/h5,7,18-20H,3-4,6,8,10-13,15-17H2,1-2H3,(H,22,23)/b7-5+/t18?,19-,20-/m0/s1