2-(4-oxidanylidene-2,3-dihydro-1,5-benzothiazepin-5-yl)ethanoic acid

Systemtic Name: 2-(4-oxidanylidene-2,3-dihydro-1,5-benzothiazepin-5-yl)ethanoic acid Openeye Name: 2-(4-oxo-2,3-dihydro-1,5-benzothiazepin-5-yl)acetic acid CAS Name: 2-(4-oxo-2,3-dihydro-1,5-benzothiazepin-5-yl)acetic acid IUPAC Name: 2-(4-oxo-2,3-dihydro-1,5-benzothiazepin-5-yl)acetic acid Traditional Name: 2-(4-keto-2,3-dihydro-1,5-benzothiazepin-5-yl)acetic acid Formula: C11H11NO3S MolecularWeight: 237.27494

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Descriptors Computed from Structure

Canonical SMILES:

C1CSC2=CC=CC=C2N(C1=O)CC(=O)O

Isomeric SMILES

C1CSC2=CC=CC=C2N(C1=O)CC(=O)O

InChI

InChI=1S/C11H11NO3S/c13-10-5-6-16-9-4-2-1-3-8(9)12(10)7-11(14)15/h1-4H,5-7H2,(H,14,15)