2-azanyl-3-(5-chloranyl-4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl)propanoic acid

Systemtic Name: 2-azanyl-3-(5-chloranyl-4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl)propanoic acid Openeye Name: 2-amino-3-(5-chloro-4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl)propanoic acid CAS Name: 2-amino-3-(5-chloro-4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl)propanoic acid IUPAC Name: 2-amino-3-(5-chloro-4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl)propanoic acid Traditional Name: 2-amino-3-(5-chloro-4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl)propionic acid Formula: C10H13ClN2O2S MolecularWeight: 260.74042

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2=C(CC1Cl)N=C(S2)CC(C(=O)O)N

Isomeric SMILES

C1CC2=C(CC1Cl)N=C(S2)CC(C(=O)O)N

InChI

InChI=1S/C10H13ClN2O2S/c11-5-1-2-8-7(3-5)13-9(16-8)4-6(12)10(14)15/h5-6H,1-4,12H2,(H,14,15)