N-[7-(3-bromophenyl)carbonyl-2,3-dihydro-1,4-benzodioxin-6-yl]thiophene-2-carboxamide

Systemtic Name: N-[7-(3-bromophenyl)carbonyl-2,3-dihydro-1,4-benzodioxin-6-yl]thiophene-2-carboxamide Openeye Name: N-[7-(3-bromobenzoyl)-2,3-dihydro-1,4-benzodioxin-6-yl]thiophene-2-carboxamide CAS Name: N-[7-[(3-bromophenyl)-oxomethyl]-2,3-dihydro-1,4-benzodioxin-6-yl]-2-thiophenecarboxamide IUPAC Name: N-[7-(3-bromobenzoyl)-2,3-dihydro-1,4-benzodioxin-6-yl]thiophene-2-carboxamide Traditional Name: N-[7-(3-bromobenzoyl)-2,3-dihydro-1,4-benzodioxin-6-yl]thiophene-2-carboxamide Formula: C20H14BrNO4S MolecularWeight: 444.29846

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C(O1)C=C(C(=C2)NC(=O)C3=CC=CS3)C(=O)C4=CC(=CC=C4)Br

Isomeric SMILES

C1COC2=C(O1)C=C(C(=C2)NC(=O)C3=CC=CS3)C(=O)C4=CC(=CC=C4)Br

InChI

InChI=1S/C20H14BrNO4S/c21-13-4-1-3-12(9-13)19(23)14-10-16-17(26-7-6-25-16)11-15(14)22-20(24)18-5-2-8-27-18/h1-5,8-11H,6-7H2,(H,22,24)