[(3S,4S)-3-oxidanyl-3-phenyl-2,4-dihydro-1,5-benzodioxepin-4-yl]-phenyl-methanone

Systemtic Name: [(3S,4S)-3-oxidanyl-3-phenyl-2,4-dihydro-1,5-benzodioxepin-4-yl]-phenyl-methanone Openeye Name: [(3S,4S)-3-hydroxy-3-phenyl-2,4-dihydro-1,5-benzodioxepin-4-yl]-phenyl-methanone CAS Name: [(3S,4S)-3-hydroxy-3-phenyl-2,4-dihydro-1,5-benzodioxepin-4-yl]-phenylmethanone IUPAC Name: [(3S,4S)-3-hydroxy-3-phenyl-2,4-dihydro-1,5-benzodioxepin-4-yl]-phenylmethanone Traditional Name: [(3S,4S)-3-hydroxy-3-phenyl-2,4-dihydro-1,5-benzodioxepin-4-yl]-phenyl-methanone Formula: C22H18O4 MolecularWeight: 346.37592

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Descriptors Computed from Structure

Canonical SMILES:

C1C(C(OC2=CC=CC=C2O1)C(=O)C3=CC=CC=C3)(C4=CC=CC=C4)O

Isomeric SMILES

C1[C@]([C@H](OC2=CC=CC=C2O1)C(=O)C3=CC=CC=C3)(C4=CC=CC=C4)O

InChI

InChI=1S/C22H18O4/c23-20(16-9-3-1-4-10-16)21-22(24,17-11-5-2-6-12-17)15-25-18-13-7-8-14-19(18)26-21/h1-14,21,24H,15H2/t21-,22-/m1/s1