2-azanyl-3-[1,1-bis(oxidanylidene)-1-benzothiophen-3-yl]propanoic acid hydrochloride

Systemtic Name: 2-azanyl-3-[1,1-bis(oxidanylidene)-1-benzothiophen-3-yl]propanoic acid hydrochloride Openeye Name: 2-amino-3-(1,1-dioxobenzothiophen-3-yl)propanoic acid hydrochloride CAS Name: 2-amino-3-(1,1-dioxo-1-benzothiophen-3-yl)propanoic acid hydrochloride IUPAC Name: 2-amino-3-(1,1-dioxo-1-benzothiophen-3-yl)propanoic acid hydrochloride Traditional Name: 2-amino-3-(1,1-diketobenzothiophen-3-yl)propionic acid hydrochloride Formula: C11H12ClNO4S MolecularWeight: 289.73528

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=CS2(=O)=O)CC(C(=O)O)N.Cl

Isomeric SMILES

C1=CC=C2C(=C1)C(=CS2(=O)=O)CC(C(=O)O)N.Cl

InChI

InChI=1S/C11H11NO4S.ClH/c12-9(11(13)14)5-7-6-17(15,16)10-4-2-1-3-8(7)10;/h1-4,6,9H,5,12H2,(H,13,14);1H