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

Systemtic Name: (2-nitrophenyl)methyl 2-phenyl-1,3-thiazole-4-carboxylate Openeye Name: (2-nitrophenyl)methyl 2-phenylthiazole-4-carboxylate CAS Name: 2-phenyl-4-thiazolecarboxylic acid (2-nitrophenyl)methyl ester IUPAC Name: (2-nitrophenyl)methyl 2-phenyl-1,3-thiazole-4-carboxylate Traditional Name: 2-phenylthiazole-4-carboxylic acid (2-nitrobenzyl) ester Formula: C17H12N2O4S MolecularWeight: 340.35318

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=NC(=CS2)C(=O)OCC3=CC=CC=C3[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)C2=NC(=CS2)C(=O)OCC3=CC=CC=C3[N+](=O)[O-]

InChI

InChI=1S/C17H12N2O4S/c20-17(23-10-13-8-4-5-9-15(13)19(21)22)14-11-24-16(18-14)12-6-2-1-3-7-12/h1-9,11H,10H2