methyl (E)-7-[2-oxidanylidene-5-(phenylmethoxymethyl)cyclopent-3-en-1-yl]hept-5-enoate

Systemtic Name: methyl (E)-7-[2-oxidanylidene-5-(phenylmethoxymethyl)cyclopent-3-en-1-yl]hept-5-enoate Openeye Name: methyl (E)-7-[2-(benzyloxymethyl)-5-oxo-cyclopent-3-en-1-yl]hept-5-enoate CAS Name: (E)-7-[2-oxo-5-(phenylmethoxymethyl)-1-cyclopent-3-enyl]-5-heptenoic acid methyl ester IUPAC Name: methyl (E)-7-[2-oxo-5-(phenylmethoxymethyl)cyclopent-3-en-1-yl]hept-5-enoate Traditional Name: (E)-7-[2-(benzoxymethyl)-5-keto-cyclopent-3-en-1-yl]hept-5-enoic acid methyl ester Formula: C21H26O4 MolecularWeight: 342.42874

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCCC=CCC1C(C=CC1=O)COCC2=CC=CC=C2

Isomeric SMILES

COC(=O)CCC/C=C/CC1C(C=CC1=O)COCC2=CC=CC=C2

InChI

InChI=1S/C21H26O4/c1-24-21(23)12-8-3-2-7-11-19-18(13-14-20(19)22)16-25-15-17-9-5-4-6-10-17/h2,4-7,9-10,13-14,18-19H,3,8,11-12,15-16H2,1H3/b7-2+