(2-phenyl-1,3-thiazol-4-yl)methyl 4-nitrobenzoate

Systemtic Name: (2-phenyl-1,3-thiazol-4-yl)methyl 4-nitrobenzoate Openeye Name: (2-phenylthiazol-4-yl)methyl 4-nitrobenzoate CAS Name: 4-nitrobenzoic acid (2-phenyl-4-thiazolyl)methyl ester IUPAC Name: (2-phenyl-1,3-thiazol-4-yl)methyl 4-nitrobenzoate Traditional Name: 4-nitrobenzoic acid (2-phenylthiazol-4-yl)methyl ester Formula: C17H12N2O4S MolecularWeight: 340.35318

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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