tert-butyl 2-[[1-cyclohexyl-5-ethyl-2,4,6-tris(oxidanylidene)-1,3-diazinan-5-yl]carbamoyl]benzoate

Systemtic Name: tert-butyl 2-[[1-cyclohexyl-5-ethyl-2,4,6-tris(oxidanylidene)-1,3-diazinan-5-yl]carbamoyl]benzoate Openeye Name: tert-butyl 2-[(1-cyclohexyl-5-ethyl-2,4,6-trioxo-hexahydropyrimidin-5-yl)carbamoyl]benzoate CAS Name: 2-[[(1-cyclohexyl-5-ethyl-2,4,6-trioxo-1,3-diazinan-5-yl)amino]-oxomethyl]benzoic acid tert-butyl ester IUPAC Name: tert-butyl 2-[(1-cyclohexyl-5-ethyl-2,4,6-trioxo-1,3-diazinan-5-yl)carbamoyl]benzoate Traditional Name: 2-[(1-cyclohexyl-5-ethyl-2,4,6-triketo-hexahydropyrimidin-5-yl)carbamoyl]benzoic acid tert-butyl ester Formula: C24H31N3O6 MolecularWeight: 457.51944

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Descriptors Computed from Structure

Canonical SMILES:

CCC1(C(=O)NC(=O)N(C1=O)C2CCCCC2)NC(=O)C3=CC=CC=C3C(=O)OC(C)(C)C

Isomeric SMILES

CCC1(C(=O)NC(=O)N(C1=O)C2CCCCC2)NC(=O)C3=CC=CC=C3C(=O)OC(C)(C)C

InChI

InChI=1S/C24H31N3O6/c1-5-24(20(30)25-22(32)27(21(24)31)15-11-7-6-8-12-15)26-18(28)16-13-9-10-14-17(16)19(29)33-23(2,3)4/h9-10,13-15H,5-8,11-12H2,1-4H3,(H,26,28)(H,25,30,32)