methyl 2-[4-(4-nitrophenyl)-1,3-thiazol-2-yl]ethanoate

Systemtic Name: methyl 2-[4-(4-nitrophenyl)-1,3-thiazol-2-yl]ethanoate Openeye Name: methyl 2-[4-(4-nitrophenyl)thiazol-2-yl]acetate CAS Name: 2-[4-(4-nitrophenyl)-2-thiazolyl]acetic acid methyl ester IUPAC Name: methyl 2-[4-(4-nitrophenyl)-1,3-thiazol-2-yl]acetate Traditional Name: 2-[4-(4-nitrophenyl)thiazol-2-yl]acetic acid methyl ester Formula: C12H10N2O4S MolecularWeight: 278.2838

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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