ethyl 2-methyl-3-(5-methyl-3-oxidanylidene-4-phenyl-1,2,4-triazolidin-1-yl)propanoate

Systemtic Name: ethyl 2-methyl-3-(5-methyl-3-oxidanylidene-4-phenyl-1,2,4-triazolidin-1-yl)propanoate Openeye Name: ethyl 2-methyl-3-(5-methyl-3-oxo-4-phenyl-1,2,4-triazolidin-1-yl)propanoate CAS Name: 2-methyl-3-(5-methyl-3-oxo-4-phenyl-1,2,4-triazolidin-1-yl)propanoic acid ethyl ester IUPAC Name: ethyl 2-methyl-3-(5-methyl-3-oxo-4-phenyl-1,2,4-triazolidin-1-yl)propanoate Traditional Name: 3-(3-keto-5-methyl-4-phenyl-1,2,4-triazolidin-1-yl)-2-methyl-propionic acid ethyl ester Formula: C15H21N3O3 MolecularWeight: 291.34554

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(C)CN1C(N(C(=O)N1)C2=CC=CC=C2)C

Isomeric SMILES

CCOC(=O)C(C)CN1C(N(C(=O)N1)C2=CC=CC=C2)C

InChI

InChI=1S/C15H21N3O3/c1-4-21-14(19)11(2)10-17-12(3)18(15(20)16-17)13-8-6-5-7-9-13/h5-9,11-12H,4,10H2,1-3H3,(H,16,20)