(2-methyl-1,3-thiazol-4-yl)methyl 4-nitrobenzoate

Systemtic Name: (2-methyl-1,3-thiazol-4-yl)methyl 4-nitrobenzoate Openeye Name: (2-methylthiazol-4-yl)methyl 4-nitrobenzoate CAS Name: 4-nitrobenzoic acid (2-methyl-4-thiazolyl)methyl ester IUPAC Name: (2-methyl-1,3-thiazol-4-yl)methyl 4-nitrobenzoate Traditional Name: 4-nitrobenzoic acid (2-methylthiazol-4-yl)methyl ester Formula: C12H10N2O4S MolecularWeight: 278.2838

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=CS1)COC(=O)C2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

CC1=NC(=CS1)COC(=O)C2=CC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C12H10N2O4S/c1-8-13-10(7-19-8)6-18-12(15)9-2-4-11(5-3-9)14(16)17/h2-5,7H,6H2,1H3