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

Systemtic Name: lithium ditert-butyl 2-[4-chloranyl-6-(diphenylamino)-1,3,5-triazin-2-yl]propanedioate Openeye Name: lithium ditert-butyl 2-[4-chloro-6-(N-phenylanilino)-1,3,5-triazin-2-yl]propanedioate CAS Name: lithium 2-[4-chloro-6-(N-phenylanilino)-1,3,5-triazin-2-yl]propanedioic acid ditert-butyl ester IUPAC Name: lithium ditert-butyl 2-[4-chloro-6-(N-phenylanilino)-1,3,5-triazin-2-yl]propanedioate Traditional Name: lithium 2-[4-chloro-6-(N-phenylanilino)-s-triazin-2-yl]malonic acid ditert-butyl ester Formula: C26H28ClLiN4O4 MolecularWeight: 502.91892

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Descriptors Computed from Structure

Canonical SMILES:

[Li+].CC(C)(C)OC(=O)[C-](C1=NC(=NC(=N1)Cl)N(C2=CC=CC=C2)C3=CC=CC=C3)C(=O)OC(C)(C)C

Isomeric SMILES

[Li+].CC(C)(C)OC(=O)[C-](C1=NC(=NC(=N1)Cl)N(C2=CC=CC=C2)C3=CC=CC=C3)C(=O)OC(C)(C)C

InChI

InChI=1S/C26H28ClN4O4.Li/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;/q-1;+1