4-(5-chloranylthiophen-2-yl)-N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-4-oxidanylidene-butanamide

Systemtic Name: 4-(5-chloranylthiophen-2-yl)-N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-4-oxidanylidene-butanamide Openeye Name: 4-(5-chloro-2-thienyl)-N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-4-oxo-butanamide CAS Name: 4-(5-chloro-2-thiophenyl)-N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-4-oxobutanamide IUPAC Name: 4-(5-chlorothiophen-2-yl)-N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-4-oxobutanamide Traditional Name: 4-(5-chloro-2-thienyl)-N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-4-keto-butyramide Formula: C17H16ClNO4S MolecularWeight: 365.83124

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C(C=C(C=C2)NC(=O)CCC(=O)C3=CC=C(S3)Cl)OC1

Isomeric SMILES

C1COC2=C(C=C(C=C2)NC(=O)CCC(=O)C3=CC=C(S3)Cl)OC1

InChI

InChI=1S/C17H16ClNO4S/c18-16-6-5-15(24-16)12(20)3-7-17(21)19-11-2-4-13-14(10-11)23-9-1-8-22-13/h2,4-6,10H,1,3,7-9H2,(H,19,21)