ethyl 2-[2-(1,3-benzoxazol-2-ylcarbonylimino)-5-nitro-1,3-benzothiazol-3-yl]ethanoate

Systemtic Name: ethyl 2-[2-(1,3-benzoxazol-2-ylcarbonylimino)-5-nitro-1,3-benzothiazol-3-yl]ethanoate Openeye Name: ethyl 2-[2-(1,3-benzoxazole-2-carbonylimino)-5-nitro-1,3-benzothiazol-3-yl]acetate CAS Name: 2-[2-[1,3-benzoxazol-2-yl(oxo)methyl]imino-5-nitro-1,3-benzothiazol-3-yl]acetic acid ethyl ester IUPAC Name: ethyl 2-[2-(1,3-benzoxazole-2-carbonylimino)-5-nitro-1,3-benzothiazol-3-yl]acetate Traditional Name: 2-[2-(1,3-benzoxazole-2-carbonylimino)-5-nitro-1,3-benzothiazol-3-yl]acetic acid ethyl ester Formula: C19H14N4O6S MolecularWeight: 426.40266

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CN1C2=C(C=CC(=C2)[N+](=O)[O-])SC1=NC(=O)C3=NC4=CC=CC=C4O3

Isomeric SMILES

CCOC(=O)CN1C2=C(C=CC(=C2)[N+](=O)[O-])SC1=NC(=O)C3=NC4=CC=CC=C4O3

InChI

InChI=1S/C19H14N4O6S/c1-2-28-16(24)10-22-13-9-11(23(26)27)7-8-15(13)30-19(22)21-17(25)18-20-12-5-3-4-6-14(12)29-18/h3-9H,2,10H2,1H3