[(2S)-1-(4-methylphenyl)-1-oxidanylidene-propan-2-yl] 2-phenyl-1,2,3-triazole-4-carboxylate

Systemtic Name: [(2S)-1-(4-methylphenyl)-1-oxidanylidene-propan-2-yl] 2-phenyl-1,2,3-triazole-4-carboxylate Openeye Name: [(1S)-1-methyl-2-oxo-2-(p-tolyl)ethyl] 2-phenyltriazole-4-carboxylate CAS Name: 2-phenyl-4-triazolecarboxylic acid [(2S)-1-(4-methylphenyl)-1-oxopropan-2-yl] ester IUPAC Name: [(2S)-1-(4-methylphenyl)-1-oxopropan-2-yl] 2-phenyltriazole-4-carboxylate Traditional Name: 2-phenyltriazole-4-carboxylic acid [(1S)-2-keto-1-methyl-2-(p-tolyl)ethyl] ester Formula: C19H17N3O3 MolecularWeight: 335.35658

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)C(C)OC(=O)C2=NN(N=C2)C3=CC=CC=C3

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)[C@H](C)OC(=O)C2=NN(N=C2)C3=CC=CC=C3

InChI

InChI=1S/C19H17N3O3/c1-13-8-10-15(11-9-13)18(23)14(2)25-19(24)17-12-20-22(21-17)16-6-4-3-5-7-16/h3-12,14H,1-2H3/t14-/m0/s1