7-methylsulfonyl-2,3,4,5-tetrahydro-1,5-benzoxazepine-9-carboxylic acid

Systemtic Name: 7-methylsulfonyl-2,3,4,5-tetrahydro-1,5-benzoxazepine-9-carboxylic acid Openeye Name: 7-methylsulfonyl-2,3,4,5-tetrahydro-1,5-benzoxazepine-9-carboxylic acid CAS Name: 7-methylsulfonyl-2,3,4,5-tetrahydro-1,5-benzoxazepine-9-carboxylic acid IUPAC Name: 7-methylsulfonyl-2,3,4,5-tetrahydro-1,5-benzoxazepine-9-carboxylic acid Traditional Name: 7-mesyl-2,3,4,5-tetrahydro-1,5-benzoxazepine-9-carboxylic acid Formula: C11H13NO5S MolecularWeight: 271.28962

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC2=C(C(=C1)C(=O)O)OCCCN2

Isomeric SMILES

CS(=O)(=O)C1=CC2=C(C(=C1)C(=O)O)OCCCN2

InChI

InChI=1S/C11H13NO5S/c1-18(15,16)7-5-8(11(13)14)10-9(6-7)12-3-2-4-17-10/h5-6,12H,2-4H2,1H3,(H,13,14)