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

Systemtic Name: ditert-butyl 2-[4-(diphenylamino)-6-morpholin-4-yl-1,3,5-triazin-2-yl]propanedioate Openeye Name: ditert-butyl 2-[4-morpholino-6-(N-phenylanilino)-1,3,5-triazin-2-yl]propanedioate CAS Name: 2-[4-(4-morpholinyl)-6-(N-phenylanilino)-1,3,5-triazin-2-yl]propanedioic acid ditert-butyl ester IUPAC Name: ditert-butyl 2-[4-morpholin-4-yl-6-(N-phenylanilino)-1,3,5-triazin-2-yl]propanedioate Traditional Name: 2-[4-morpholino-6-(N-phenylanilino)-s-triazin-2-yl]malonic acid ditert-butyl ester Formula: C30H37N5O5 MolecularWeight: 547.64528

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)C(C1=NC(=NC(=N1)N(C2=CC=CC=C2)C3=CC=CC=C3)N4CCOCC4)C(=O)OC(C)(C)C

Isomeric SMILES

CC(C)(C)OC(=O)C(C1=NC(=NC(=N1)N(C2=CC=CC=C2)C3=CC=CC=C3)N4CCOCC4)C(=O)OC(C)(C)C

InChI

InChI=1S/C30H37N5O5/c1-29(2,3)39-25(36)23(26(37)40-30(4,5)6)24-31-27(34-17-19-38-20-18-34)33-28(32-24)35(21-13-9-7-10-14-21)22-15-11-8-12-16-22/h7-16,23H,17-20H2,1-6H3