7-ethanoyl-5-(phenylmethyl)-5-(phenylsulfonyl)-4H-1-benzoxepin-3-one

Systemtic Name: 7-ethanoyl-5-(phenylmethyl)-5-(phenylsulfonyl)-4H-1-benzoxepin-3-one Openeye Name: 7-acetyl-5-(benzenesulfonyl)-5-benzyl-4H-1-benzoxepin-3-one CAS Name: 7-acetyl-5-(benzenesulfonyl)-5-(phenylmethyl)-4H-1-benzoxepin-3-one IUPAC Name: 7-acetyl-5-(benzenesulfonyl)-5-benzyl-4H-1-benzoxepin-3-one Traditional Name: 7-acetyl-5-benzyl-5-besyl-4H-1-benzoxepin-3-one Formula: C25H22O5S MolecularWeight: 434.50418

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC2=C(C=C1)OCC(=O)CC2(CC3=CC=CC=C3)S(=O)(=O)C4=CC=CC=C4

Isomeric SMILES

CC(=O)C1=CC2=C(C=C1)OCC(=O)CC2(CC3=CC=CC=C3)S(=O)(=O)C4=CC=CC=C4

InChI

InChI=1S/C25H22O5S/c1-18(26)20-12-13-24-23(14-20)25(16-21(27)17-30-24,15-19-8-4-2-5-9-19)31(28,29)22-10-6-3-7-11-22/h2-14H,15-17H2,1H3