[2-(4-methylphenyl)-1,3-thiazol-4-yl]methyl 2-nitrobenzoate

Systemtic Name: [2-(4-methylphenyl)-1,3-thiazol-4-yl]methyl 2-nitrobenzoate Openeye Name: [2-(p-tolyl)thiazol-4-yl]methyl 2-nitrobenzoate CAS Name: 2-nitrobenzoic acid [2-(4-methylphenyl)-4-thiazolyl]methyl ester IUPAC Name: [2-(4-methylphenyl)-1,3-thiazol-4-yl]methyl 2-nitrobenzoate Traditional Name: 2-nitrobenzoic acid [2-(p-tolyl)thiazol-4-yl]methyl ester Formula: C18H14N2O4S MolecularWeight: 354.37976

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=NC(=CS2)COC(=O)C3=CC=CC=C3[N+](=O)[O-]

Isomeric SMILES

CC1=CC=C(C=C1)C2=NC(=CS2)COC(=O)C3=CC=CC=C3[N+](=O)[O-]

InChI

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