(2-phenyl-1,3-thiazol-4-yl)methyl 4,5-dimethoxy-2-nitro-benzoate

Systemtic Name: (2-phenyl-1,3-thiazol-4-yl)methyl 4,5-dimethoxy-2-nitro-benzoate Openeye Name: (2-phenylthiazol-4-yl)methyl 4,5-dimethoxy-2-nitro-benzoate CAS Name: 4,5-dimethoxy-2-nitrobenzoic acid (2-phenyl-4-thiazolyl)methyl ester IUPAC Name: (2-phenyl-1,3-thiazol-4-yl)methyl 4,5-dimethoxy-2-nitrobenzoate Traditional Name: 4,5-dimethoxy-2-nitro-benzoic acid (2-phenylthiazol-4-yl)methyl ester Formula: C19H16N2O6S MolecularWeight: 400.40514

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C(=C1)C(=O)OCC2=CSC(=N2)C3=CC=CC=C3)[N+](=O)[O-])OC

Isomeric SMILES

COC1=C(C=C(C(=C1)C(=O)OCC2=CSC(=N2)C3=CC=CC=C3)[N+](=O)[O-])OC

InChI

InChI=1S/C19H16N2O6S/c1-25-16-8-14(15(21(23)24)9-17(16)26-2)19(22)27-10-13-11-28-18(20-13)12-6-4-3-5-7-12/h3-9,11H,10H2,1-2H3