dimethyl (2Z)-2-(2,4,5-triphenyl-1,2,4-triazol-3-ylidene)butanedioate

Systemtic Name: dimethyl (2Z)-2-(2,4,5-triphenyl-1,2,4-triazol-3-ylidene)butanedioate Openeye Name: dimethyl (2Z)-2-(2,4,5-triphenyl-1,2,4-triazol-3-ylidene)butanedioate CAS Name: (2Z)-2-(2,4,5-triphenyl-1,2,4-triazol-3-ylidene)butanedioic acid dimethyl ester IUPAC Name: dimethyl (2Z)-2-(2,4,5-triphenyl-1,2,4-triazol-3-ylidene)butanedioate Traditional Name: (2Z)-2-(2,4,5-triphenyl-1,2,4-triazol-3-ylidene)succinic acid dimethyl ester Formula: C26H23N3O4 MolecularWeight: 441.47852

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CC(=C1N(C(=NN1C2=CC=CC=C2)C3=CC=CC=C3)C4=CC=CC=C4)C(=O)OC

Isomeric SMILES

COC(=O)C/C(=C/1\N(C(=NN1C2=CC=CC=C2)C3=CC=CC=C3)C4=CC=CC=C4)/C(=O)OC

InChI

InChI=1S/C26H23N3O4/c1-32-23(30)18-22(26(31)33-2)25-28(20-14-8-4-9-15-20)24(19-12-6-3-7-13-19)27-29(25)21-16-10-5-11-17-21/h3-17H,18H2,1-2H3/b25-22-