diethyl 3,4,5-triphenyl-1,2,4-triazolidine-1,2-dicarboxylate

Systemtic Name: diethyl 3,4,5-triphenyl-1,2,4-triazolidine-1,2-dicarboxylate Openeye Name: diethyl 3,4,5-triphenyl-1,2,4-triazolidine-1,2-dicarboxylate CAS Name: 3,4,5-triphenyl-1,2,4-triazolidine-1,2-dicarboxylic acid diethyl ester IUPAC Name: diethyl 3,4,5-triphenyl-1,2,4-triazolidine-1,2-dicarboxylate Traditional Name: 3,4,5-triphenyl-1,2,4-triazolidine-1,2-dicarboxylic acid diethyl ester Formula: C26H27N3O4 MolecularWeight: 445.51028

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C26H27N3O4/c1-3-32-25(30)28-23(20-14-8-5-9-15-20)27(22-18-12-7-13-19-22)24(21-16-10-6-11-17-21)29(28)26(31)33-4-2/h5-19,23-24H,3-4H2,1-2H3