(2-nitrophenyl)methyl 4-methyl-2-phenyl-1,3-thiazole-5-carboxylate

Systemtic Name: (2-nitrophenyl)methyl 4-methyl-2-phenyl-1,3-thiazole-5-carboxylate Openeye Name: (2-nitrophenyl)methyl 4-methyl-2-phenyl-thiazole-5-carboxylate CAS Name: 4-methyl-2-phenyl-5-thiazolecarboxylic acid (2-nitrophenyl)methyl ester IUPAC Name: (2-nitrophenyl)methyl 4-methyl-2-phenyl-1,3-thiazole-5-carboxylate Traditional Name: 4-methyl-2-phenyl-thiazole-5-carboxylic acid (2-nitrobenzyl) ester Formula: C18H14N2O4S MolecularWeight: 354.37976

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=N1)C2=CC=CC=C2)C(=O)OCC3=CC=CC=C3[N+](=O)[O-]

Isomeric SMILES

CC1=C(SC(=N1)C2=CC=CC=C2)C(=O)OCC3=CC=CC=C3[N+](=O)[O-]

InChI

InChI=1S/C18H14N2O4S/c1-12-16(25-17(19-12)13-7-3-2-4-8-13)18(21)24-11-14-9-5-6-10-15(14)20(22)23/h2-10H,11H2,1H3