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

Systemtic Name: (2-acetamido-1,3-thiazol-4-yl)methyl 4,5-dimethoxy-2-nitro-benzoate Openeye Name: (2-acetamidothiazol-4-yl)methyl 4,5-dimethoxy-2-nitro-benzoate CAS Name: 4,5-dimethoxy-2-nitrobenzoic acid (2-acetamido-4-thiazolyl)methyl ester IUPAC Name: (2-acetamido-1,3-thiazol-4-yl)methyl 4,5-dimethoxy-2-nitrobenzoate Traditional Name: 4,5-dimethoxy-2-nitro-benzoic acid (2-acetamidothiazol-4-yl)methyl ester Formula: C15H15N3O7S MolecularWeight: 381.3605

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=NC(=CS1)COC(=O)C2=CC(=C(C=C2[N+](=O)[O-])OC)OC

Isomeric SMILES

CC(=O)NC1=NC(=CS1)COC(=O)C2=CC(=C(C=C2[N+](=O)[O-])OC)OC

InChI

InChI=1S/C15H15N3O7S/c1-8(19)16-15-17-9(7-26-15)6-25-14(20)10-4-12(23-2)13(24-3)5-11(10)18(21)22/h4-5,7H,6H2,1-3H3,(H,16,17,19)