1,2,4,5-tetrahydro-3-benzothiepin-7-ylcarbamic acid

Systemtic Name: 1,2,4,5-tetrahydro-3-benzothiepin-7-ylcarbamic acid Openeye Name: 1,2,4,5-tetrahydro-3-benzothiepin-7-ylcarbamic acid CAS Name: 1,2,4,5-tetrahydro-3-benzothiepin-7-ylcarbamic acid IUPAC Name: 1,2,4,5-tetrahydro-3-benzothiepin-7-ylcarbamic acid Traditional Name: 1,2,4,5-tetrahydro-3-benzothiepin-7-ylcarbamic acid Formula: C11H13NO2S MolecularWeight: 223.29142

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Descriptors Computed from Structure

Canonical SMILES:

C1CSCCC2=C1C=CC(=C2)NC(=O)O

Isomeric SMILES

C1CSCCC2=C1C=CC(=C2)NC(=O)O

InChI

InChI=1S/C11H13NO2S/c13-11(14)12-10-2-1-8-3-5-15-6-4-9(8)7-10/h1-2,7,12H,3-6H2,(H,13,14)