2,3,4,5-tetrahydro-1H-3-benzazepine-7-sulfonic acid

Systemtic Name: 2,3,4,5-tetrahydro-1H-3-benzazepine-7-sulfonic acid Openeye Name: 2,3,4,5-tetrahydro-1H-3-benzazepine-7-sulfonic acid CAS Name: 2,3,4,5-tetrahydro-1H-3-benzazepine-7-sulfonic acid IUPAC Name: 2,3,4,5-tetrahydro-1H-3-benzazepine-7-sulfonic acid Traditional Name: 2,3,4,5-tetrahydro-1H-3-benzazepine-7-sulfonic acid Formula: C10H13NO3S MolecularWeight: 227.28012

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Descriptors Computed from Structure

Canonical SMILES:

C1CNCCC2=C1C=CC(=C2)S(=O)(=O)O

Isomeric SMILES

C1CNCCC2=C1C=CC(=C2)S(=O)(=O)O

InChI

InChI=1S/C10H13NO3S/c12-15(13,14)10-2-1-8-3-5-11-6-4-9(8)7-10/h1-2,7,11H,3-6H2,(H,12,13,14)