(7-bromanyl-4-oxidanylidene-3,5-dihydro-2H-1,5-benzothiazepin-3-yl)carbamic acid

Systemtic Name: (7-bromanyl-4-oxidanylidene-3,5-dihydro-2H-1,5-benzothiazepin-3-yl)carbamic acid Openeye Name: (7-bromo-4-oxo-3,5-dihydro-2H-1,5-benzothiazepin-3-yl)carbamic acid CAS Name: (7-bromo-4-oxo-3,5-dihydro-2H-1,5-benzothiazepin-3-yl)carbamic acid IUPAC Name: (7-bromo-4-oxo-3,5-dihydro-2H-1,5-benzothiazepin-3-yl)carbamic acid Traditional Name: (7-bromo-4-keto-3,5-dihydro-2H-1,5-benzothiazepin-3-yl)carbamic acid Formula: C10H9BrN2O3S MolecularWeight: 317.15906

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Descriptors Computed from Structure

Canonical SMILES:

C1C(C(=O)NC2=C(S1)C=CC(=C2)Br)NC(=O)O

Isomeric SMILES

C1C(C(=O)NC2=C(S1)C=CC(=C2)Br)NC(=O)O

InChI

InChI=1S/C10H9BrN2O3S/c11-5-1-2-8-6(3-5)12-9(14)7(4-17-8)13-10(15)16/h1-3,7,13H,4H2,(H,12,14)(H,15,16)