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

Systemtic Name: 2-[(2-methyl-6-nitro-1,3-benzothiazol-5-yl)amino]ethanoic acid Openeye Name: 2-[(2-methyl-6-nitro-1,3-benzothiazol-5-yl)amino]acetic acid CAS Name: 2-[(2-methyl-6-nitro-1,3-benzothiazol-5-yl)amino]acetic acid IUPAC Name: 2-[(2-methyl-6-nitro-1,3-benzothiazol-5-yl)amino]acetic acid Traditional Name: 2-[(2-methyl-6-nitro-1,3-benzothiazol-5-yl)amino]acetic acid Formula: C10H9N3O4S MolecularWeight: 267.26116

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C10H9N3O4S/c1-5-12-7-2-6(11-4-10(14)15)8(13(16)17)3-9(7)18-5/h2-3,11H,4H2,1H3,(H,14,15)