(4E)-4-(phenylmethylidene)-2,3-dihydro-1-benzothiepin-5-one

Systemtic Name: (4E)-4-(phenylmethylidene)-2,3-dihydro-1-benzothiepin-5-one Openeye Name: (4E)-4-benzylidene-2,3-dihydro-1-benzothiepin-5-one CAS Name: (4E)-4-(phenylmethylene)-2,3-dihydro-1-benzothiepin-5-one IUPAC Name: (4E)-4-benzylidene-2,3-dihydro-1-benzothiepin-5-one Traditional Name: (4E)-4-benzal-2,3-dihydro-1-benzothiepin-5-one Formula: C17H14OS MolecularWeight: 266.35746

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Descriptors Computed from Structure

Canonical SMILES:

C1CSC2=CC=CC=C2C(=O)C1=CC3=CC=CC=C3

Isomeric SMILES

C\1CSC2=CC=CC=C2C(=O)/C1=C/C3=CC=CC=C3

InChI

InChI=1S/C17H14OS/c18-17-14(12-13-6-2-1-3-7-13)10-11-19-16-9-5-4-8-15(16)17/h1-9,12H,10-11H2/b14-12+