propan-2-yl 4-methyl-2-(3-nitro-4-propan-2-yloxy-phenyl)-1,3-thiazole-5-carboxylate

Systemtic Name: propan-2-yl 4-methyl-2-(3-nitro-4-propan-2-yloxy-phenyl)-1,3-thiazole-5-carboxylate Openeye Name: isopropyl 2-(4-isopropoxy-3-nitro-phenyl)-4-methyl-thiazole-5-carboxylate CAS Name: 4-methyl-2-(3-nitro-4-propan-2-yloxyphenyl)-5-thiazolecarboxylic acid propan-2-yl ester IUPAC Name: propan-2-yl 4-methyl-2-(3-nitro-4-propan-2-yloxyphenyl)-1,3-thiazole-5-carboxylate Traditional Name: 2-(4-isopropoxy-3-nitro-phenyl)-4-methyl-thiazole-5-carboxylic acid isopropyl ester Formula: C17H20N2O5S MolecularWeight: 364.4161

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=N1)C2=CC(=C(C=C2)OC(C)C)[N+](=O)[O-])C(=O)OC(C)C

Isomeric SMILES

CC1=C(SC(=N1)C2=CC(=C(C=C2)OC(C)C)[N+](=O)[O-])C(=O)OC(C)C

InChI

InChI=1S/C17H20N2O5S/c1-9(2)23-14-7-6-12(8-13(14)19(21)22)16-18-11(5)15(25-16)17(20)24-10(3)4/h6-10H,1-5H3