(4-oxidanylidene-4-phenyl-butyl) 5-methyl-2-phenyl-1,2,3-triazole-4-carboxylate

Systemtic Name: (4-oxidanylidene-4-phenyl-butyl) 5-methyl-2-phenyl-1,2,3-triazole-4-carboxylate Openeye Name: (4-oxo-4-phenyl-butyl) 5-methyl-2-phenyl-triazole-4-carboxylate CAS Name: 5-methyl-2-phenyl-4-triazolecarboxylic acid (4-oxo-4-phenylbutyl) ester IUPAC Name: (4-oxo-4-phenylbutyl) 5-methyl-2-phenyltriazole-4-carboxylate Traditional Name: 5-methyl-2-phenyl-triazole-4-carboxylic acid (4-keto-4-phenyl-butyl) ester Formula: C20H19N3O3 MolecularWeight: 349.38316

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(N=C1C(=O)OCCCC(=O)C2=CC=CC=C2)C3=CC=CC=C3

Isomeric SMILES

CC1=NN(N=C1C(=O)OCCCC(=O)C2=CC=CC=C2)C3=CC=CC=C3

InChI

InChI=1S/C20H19N3O3/c1-15-19(22-23(21-15)17-11-6-3-7-12-17)20(25)26-14-8-13-18(24)16-9-4-2-5-10-16/h2-7,9-12H,8,13-14H2,1H3