(E)-7-(cyclopenten-1-yl)-2-[(3-methylphenyl)methoxymethyl]hept-5-enoic acid

Systemtic Name: (E)-7-(cyclopenten-1-yl)-2-[(3-methylphenyl)methoxymethyl]hept-5-enoic acid Openeye Name: (E)-7-(cyclopenten-1-yl)-2-(m-tolylmethoxymethyl)hept-5-enoic acid CAS Name: (E)-7-(1-cyclopentenyl)-2-[(3-methylphenyl)methoxymethyl]-5-heptenoic acid IUPAC Name: (E)-7-(cyclopenten-1-yl)-2-[(3-methylphenyl)methoxymethyl]hept-5-enoic acid Traditional Name: (E)-7-(cyclopenten-1-yl)-2-[(3-methylbenzyl)oxymethyl]hept-5-enoic acid Formula: C21H28O3 MolecularWeight: 328.44522

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)COCC(CCC=CCC2=CCCC2)C(=O)O

Isomeric SMILES

CC1=CC(=CC=C1)COCC(CC/C=C/CC2=CCCC2)C(=O)O

InChI

InChI=1S/C21H28O3/c1-17-8-7-12-19(14-17)15-24-16-20(21(22)23)13-4-2-3-9-18-10-5-6-11-18/h2-3,7-8,10,12,14,20H,4-6,9,11,13,15-16H2,1H3,(H,22,23)/b3-2+