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

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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