ethyl 2-(2-ethanoylimino-6-nitro-1,3-benzothiazol-3-yl)ethanoate

Systemtic Name: ethyl 2-(2-ethanoylimino-6-nitro-1,3-benzothiazol-3-yl)ethanoate Openeye Name: ethyl 2-(2-acetylimino-6-nitro-1,3-benzothiazol-3-yl)acetate CAS Name: 2-(2-acetylimino-6-nitro-1,3-benzothiazol-3-yl)acetic acid ethyl ester IUPAC Name: ethyl 2-(2-acetylimino-6-nitro-1,3-benzothiazol-3-yl)acetate Traditional Name: 2-(2-acetylimino-6-nitro-1,3-benzothiazol-3-yl)acetic acid ethyl ester Formula: C13H13N3O5S MolecularWeight: 323.32442

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CN1C2=C(C=C(C=C2)[N+](=O)[O-])SC1=NC(=O)C

Isomeric SMILES

CCOC(=O)CN1C2=C(C=C(C=C2)[N+](=O)[O-])SC1=NC(=O)C

InChI

InChI=1S/C13H13N3O5S/c1-3-21-12(18)7-15-10-5-4-9(16(19)20)6-11(10)22-13(15)14-8(2)17/h4-6H,3,7H2,1-2H3