2-[methyl-(2-methyl-6-nitro-1,3-benzothiazol-5-yl)amino]ethanoic acid

Systemtic Name: 2-[methyl-(2-methyl-6-nitro-1,3-benzothiazol-5-yl)amino]ethanoic acid Openeye Name: 2-[methyl-(2-methyl-6-nitro-1,3-benzothiazol-5-yl)amino]acetic acid CAS Name: 2-[methyl-(2-methyl-6-nitro-1,3-benzothiazol-5-yl)amino]acetic acid IUPAC Name: 2-[methyl-(2-methyl-6-nitro-1,3-benzothiazol-5-yl)amino]acetic acid Traditional Name: 2-[methyl-(2-methyl-6-nitro-1,3-benzothiazol-5-yl)amino]acetic acid Formula: C11H11N3O4S MolecularWeight: 281.28774

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=CC(=C(C=C2S1)[N+](=O)[O-])N(C)CC(=O)O

Isomeric SMILES

CC1=NC2=CC(=C(C=C2S1)[N+](=O)[O-])N(C)CC(=O)O

InChI

InChI=1S/C11H11N3O4S/c1-6-12-7-3-8(13(2)5-11(15)16)9(14(17)18)4-10(7)19-6/h3-4H,5H2,1-2H3,(H,15,16)