2-[(4-nitrophenyl)methyl]-1,3-thiazol-4-one

Systemtic Name: 2-[(4-nitrophenyl)methyl]-1,3-thiazol-4-one Openeye Name: 2-[(4-nitrophenyl)methyl]thiazol-4-one CAS Name: 2-[(4-nitrophenyl)methyl]-4-thiazolone IUPAC Name: 2-[(4-nitrophenyl)methyl]-1,3-thiazol-4-one Traditional Name: 2-(4-nitrobenzyl)-2-thiazolin-4-one Formula: C10H8N2O3S MolecularWeight: 236.24712

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Descriptors Computed from Structure

Canonical SMILES:

C1C(=O)N=C(S1)CC2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

C1C(=O)N=C(S1)CC2=CC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C10H8N2O3S/c13-9-6-16-10(11-9)5-7-1-3-8(4-2-7)12(14)15/h1-4H,5-6H2