methyl 3-azanyl-3-(5-chloranyl-1,3-benzothiazol-2-yl)propanoate

Systemtic Name: methyl 3-azanyl-3-(5-chloranyl-1,3-benzothiazol-2-yl)propanoate Openeye Name: methyl 3-amino-3-(5-chloro-1,3-benzothiazol-2-yl)propanoate CAS Name: 3-amino-3-(5-chloro-1,3-benzothiazol-2-yl)propanoic acid methyl ester IUPAC Name: methyl 3-amino-3-(5-chloro-1,3-benzothiazol-2-yl)propanoate Traditional Name: 3-amino-3-(5-chloro-1,3-benzothiazol-2-yl)propionic acid methyl ester Formula: C11H11ClN2O2S MolecularWeight: 270.73524

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CC(C1=NC2=C(S1)C=CC(=C2)Cl)N

Isomeric SMILES

COC(=O)CC(C1=NC2=C(S1)C=CC(=C2)Cl)N

InChI

InChI=1S/C11H11ClN2O2S/c1-16-10(15)5-7(13)11-14-8-4-6(12)2-3-9(8)17-11/h2-4,7H,5,13H2,1H3