(4S,5S,6R,7S)-4-oxidanyl-5,6,7-tris(phenylmethoxy)cyclohept-2-en-1-one

Systemtic Name: (4S,5S,6R,7S)-4-oxidanyl-5,6,7-tris(phenylmethoxy)cyclohept-2-en-1-one Openeye Name: (4S,5S,6R,7S)-5,6,7-tribenzyloxy-4-hydroxy-cyclohept-2-en-1-one CAS Name: (4S,5S,6R,7S)-4-hydroxy-5,6,7-tris(phenylmethoxy)-1-cyclohept-2-enone IUPAC Name: (4S,5S,6R,7S)-4-hydroxy-5,6,7-tris(phenylmethoxy)cyclohept-2-en-1-one Traditional Name: (4S,5S,6R,7S)-5,6,7-tribenzoxy-4-hydroxy-cyclohept-2-en-1-one Formula: C28H28O5 MolecularWeight: 444.51892

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC2C(C=CC(=O)C(C2OCC3=CC=CC=C3)OCC4=CC=CC=C4)O

Isomeric SMILES

C1=CC=C(C=C1)CO[C@H]2[C@H](C=CC(=O)[C@H]([C@@H]2OCC3=CC=CC=C3)OCC4=CC=CC=C4)O

InChI

InChI=1S/C28H28O5/c29-24-16-17-25(30)27(32-19-22-12-6-2-7-13-22)28(33-20-23-14-8-3-9-15-23)26(24)31-18-21-10-4-1-5-11-21/h1-17,24,26-29H,18-20H2/t24-,26-,27+,28+/m0/s1