ethyl 3-oxidanylidene-4,5,5-triphenyl-1,2,4-triazolidine-1-carboxylate

Systemtic Name: ethyl 3-oxidanylidene-4,5,5-triphenyl-1,2,4-triazolidine-1-carboxylate Openeye Name: ethyl 3-oxo-4,5,5-triphenyl-1,2,4-triazolidine-1-carboxylate CAS Name: 3-oxo-4,5,5-triphenyl-1,2,4-triazolidine-1-carboxylic acid ethyl ester IUPAC Name: ethyl 3-oxo-4,5,5-triphenyl-1,2,4-triazolidine-1-carboxylate Traditional Name: 3-keto-4,5,5-triphenyl-1,2,4-triazolidine-1-carboxylic acid ethyl ester Formula: C23H21N3O3 MolecularWeight: 387.43114

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1C(N(C(=O)N1)C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

CCOC(=O)N1C(N(C(=O)N1)C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C23H21N3O3/c1-2-29-22(28)26-23(18-12-6-3-7-13-18,19-14-8-4-9-15-19)25(21(27)24-26)20-16-10-5-11-17-20/h3-17H,2H2,1H3,(H,24,27)