ditert-butyl 2-[6-chloranyl-4-(diphenylamino)-1H-1,3,5-triazin-2-ylidene]propanedioate

Systemtic Name: ditert-butyl 2-[6-chloranyl-4-(diphenylamino)-1H-1,3,5-triazin-2-ylidene]propanedioate Openeye Name: ditert-butyl 2-[6-chloro-4-(N-phenylanilino)-1H-1,3,5-triazin-2-ylidene]propanedioate CAS Name: 2-[6-chloro-4-(N-phenylanilino)-1H-1,3,5-triazin-2-ylidene]propanedioic acid ditert-butyl ester IUPAC Name: ditert-butyl 2-[6-chloro-4-(N-phenylanilino)-1H-1,3,5-triazin-2-ylidene]propanedioate Traditional Name: 2-[6-chloro-4-(N-phenylanilino)-1H-s-triazin-2-ylidene]malonic acid ditert-butyl ester Formula: C26H29ClN4O4 MolecularWeight: 496.98586

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)C(=C1NC(=NC(=N1)N(C2=CC=CC=C2)C3=CC=CC=C3)Cl)C(=O)OC(C)(C)C

Isomeric SMILES

CC(C)(C)OC(=O)C(=C1NC(=NC(=N1)N(C2=CC=CC=C2)C3=CC=CC=C3)Cl)C(=O)OC(C)(C)C

InChI

InChI=1S/C26H29ClN4O4/c1-25(2,3)34-21(32)19(22(33)35-26(4,5)6)20-28-23(27)30-24(29-20)31(17-13-9-7-10-14-17)18-15-11-8-12-16-18/h7-16H,1-6H3,(H,28,29,30)