2-[(E)-7-methoxy-7-oxidanylidene-hept-2-enyl]-3-[(4-phenylphenyl)methoxy]cyclopentane-1-carboxylic acid

Systemtic Name: 2-[(E)-7-methoxy-7-oxidanylidene-hept-2-enyl]-3-[(4-phenylphenyl)methoxy]cyclopentane-1-carboxylic acid Openeye Name: 2-[(E)-7-methoxy-7-oxo-hept-2-enyl]-3-[(4-phenylphenyl)methoxy]cyclopentanecarboxylic acid CAS Name: 2-[(E)-7-methoxy-7-oxohept-2-enyl]-3-[(4-phenylphenyl)methoxy]-1-cyclopentanecarboxylic acid IUPAC Name: 2-[(E)-7-methoxy-7-oxohept-2-enyl]-3-[(4-phenylphenyl)methoxy]cyclopentane-1-carboxylic acid Traditional Name: 2-[(E)-7-keto-7-methoxy-hept-2-enyl]-3-(4-phenylbenzyl)oxy-cyclopentanecarboxylic acid Formula: C27H32O5 MolecularWeight: 436.53998

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCCC=CCC1C(CCC1OCC2=CC=C(C=C2)C3=CC=CC=C3)C(=O)O

Isomeric SMILES

COC(=O)CCC/C=C/CC1C(CCC1OCC2=CC=C(C=C2)C3=CC=CC=C3)C(=O)O

InChI

InChI=1S/C27H32O5/c1-31-26(28)12-8-3-2-7-11-23-24(27(29)30)17-18-25(23)32-19-20-13-15-22(16-14-20)21-9-5-4-6-10-21/h2,4-7,9-10,13-16,23-25H,3,8,11-12,17-19H2,1H3,(H,29,30)/b7-2+