3,5-dihydro-2H-1,4-benzoxazepine-4-sulfonic acid

Systemtic Name: 3,5-dihydro-2H-1,4-benzoxazepine-4-sulfonic acid Openeye Name: 3,5-dihydro-2H-1,4-benzoxazepine-4-sulfonic acid CAS Name: 3,5-dihydro-2H-1,4-benzoxazepine-4-sulfonic acid IUPAC Name: 3,5-dihydro-2H-1,4-benzoxazepine-4-sulfonic acid Traditional Name: 3,5-dihydro-2H-1,4-benzoxazepine-4-sulfonic acid Formula: C9H11NO4S MolecularWeight: 229.25294

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=CC=CC=C2CN1S(=O)(=O)O

Isomeric SMILES

C1COC2=CC=CC=C2CN1S(=O)(=O)O

InChI

InChI=1S/C9H11NO4S/c11-15(12,13)10-5-6-14-9-4-2-1-3-8(9)7-10/h1-4H,5-7H2,(H,11,12,13)