2-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfanyl)-2-phenyl-ethanamide

Systemtic Name: 2-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfanyl)-2-phenyl-ethanamide Openeye Name: 2-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfanyl)-2-phenyl-acetamide CAS Name: 2-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylthio)-2-phenylacetamide IUPAC Name: 2-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfanyl)-2-phenylacetamide Traditional Name: 2-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylthio)-2-phenyl-acetamide Formula: C17H17NO3S MolecularWeight: 315.38678

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C(C=C(C=C2)SC(C3=CC=CC=C3)C(=O)N)OC1

Isomeric SMILES

C1COC2=C(C=C(C=C2)SC(C3=CC=CC=C3)C(=O)N)OC1

InChI

InChI=1S/C17H17NO3S/c18-17(19)16(12-5-2-1-3-6-12)22-13-7-8-14-15(11-13)21-10-4-9-20-14/h1-3,5-8,11,16H,4,9-10H2,(H2,18,19)