2-[(4-bromophenyl)sulfonylmethyl]-4H-1,3,4-benzoxadiazepin-5-one

Systemtic Name: 2-[(4-bromophenyl)sulfonylmethyl]-4H-1,3,4-benzoxadiazepin-5-one Openeye Name: 2-[(4-bromophenyl)sulfonylmethyl]-4H-1,3,4-benzoxadiazepin-5-one CAS Name: 2-[(4-bromophenyl)sulfonylmethyl]-4H-1,3,4-benzoxadiazepin-5-one IUPAC Name: 2-[(4-bromophenyl)sulfonylmethyl]-4H-1,3,4-benzoxadiazepin-5-one Traditional Name: 2-(brosylmethyl)-4H-1,3,4-benzoxadiazepin-5-one Formula: C15H11BrN2O4S MolecularWeight: 395.22784

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)NN=C(O2)CS(=O)(=O)C3=CC=C(C=C3)Br

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)NN=C(O2)CS(=O)(=O)C3=CC=C(C=C3)Br

InChI

InChI=1S/C15H11BrN2O4S/c16-10-5-7-11(8-6-10)23(20,21)9-14-17-18-15(19)12-3-1-2-4-13(12)22-14/h1-8H,9H2,(H,18,19)