[3a-(hydroxymethyl)-2-oxidanylidene-3,4,5,6-tetrahydrocyclopenta[b]furan-6a-yl] 4-phenylbenzoate

Systemtic Name: [3a-(hydroxymethyl)-2-oxidanylidene-3,4,5,6-tetrahydrocyclopenta[b]furan-6a-yl] 4-phenylbenzoate Openeye Name: [3a-(hydroxymethyl)-2-oxo-3,4,5,6-tetrahydrocyclopenta[b]furan-6a-yl] 4-phenylbenzoate CAS Name: 4-phenylbenzoic acid [3a-(hydroxymethyl)-2-oxo-3,4,5,6-tetrahydrocyclopenta[b]furan-6a-yl] ester IUPAC Name: [3a-(hydroxymethyl)-2-oxo-3,4,5,6-tetrahydrocyclopenta[b]furan-6a-yl] 4-phenylbenzoate Traditional Name: 4-phenylbenzoic acid (2-keto-3a-methylol-3,4,5,6-tetrahydrocyclopenta[b]furan-6a-yl) ester Formula: C21H20O5 MolecularWeight: 352.3805

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2(CC(=O)OC2(C1)OC(=O)C3=CC=C(C=C3)C4=CC=CC=C4)CO

Isomeric SMILES

C1CC2(CC(=O)OC2(C1)OC(=O)C3=CC=C(C=C3)C4=CC=CC=C4)CO

InChI

InChI=1S/C21H20O5/c22-14-20-11-4-12-21(20,25-18(23)13-20)26-19(24)17-9-7-16(8-10-17)15-5-2-1-3-6-15/h1-3,5-10,22H,4,11-14H2