ethyl 2-[2-[(3-methyl-1,2-oxazol-5-yl)carbonylimino]-6-nitro-1,3-benzothiazol-3-yl]ethanoate

Systemtic Name: ethyl 2-[2-[(3-methyl-1,2-oxazol-5-yl)carbonylimino]-6-nitro-1,3-benzothiazol-3-yl]ethanoate Openeye Name: ethyl 2-[2-(3-methylisoxazole-5-carbonyl)imino-6-nitro-1,3-benzothiazol-3-yl]acetate CAS Name: 2-[2-[(3-methyl-5-isoxazolyl)-oxomethyl]imino-6-nitro-1,3-benzothiazol-3-yl]acetic acid ethyl ester IUPAC Name: ethyl 2-[2-(3-methyl-1,2-oxazole-5-carbonyl)imino-6-nitro-1,3-benzothiazol-3-yl]acetate Traditional Name: 2-[2-(3-methylisoxazole-5-carbonyl)imino-6-nitro-1,3-benzothiazol-3-yl]acetic acid ethyl ester Formula: C16H14N4O6S MolecularWeight: 390.37056

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CN1C2=C(C=C(C=C2)[N+](=O)[O-])SC1=NC(=O)C3=CC(=NO3)C

Isomeric SMILES

CCOC(=O)CN1C2=C(C=C(C=C2)[N+](=O)[O-])SC1=NC(=O)C3=CC(=NO3)C

InChI

InChI=1S/C16H14N4O6S/c1-3-25-14(21)8-19-11-5-4-10(20(23)24)7-13(11)27-16(19)17-15(22)12-6-9(2)18-26-12/h4-7H,3,8H2,1-2H3