ethyl (4R,6R)-3-(diphenylmethyl)-6-(iodanylmethyl)-4-methyl-2-oxidanylidene-1,3-diazinane-1-carboxylate

Systemtic Name: ethyl (4R,6R)-3-(diphenylmethyl)-6-(iodanylmethyl)-4-methyl-2-oxidanylidene-1,3-diazinane-1-carboxylate Openeye Name: ethyl (4R,6R)-3-benzhydryl-6-(iodomethyl)-4-methyl-2-oxo-hexahydropyrimidine-1-carboxylate CAS Name: (4R,6R)-3-(diphenylmethyl)-6-(iodomethyl)-4-methyl-2-oxo-1,3-diazinane-1-carboxylic acid ethyl ester IUPAC Name: ethyl (4R,6R)-3-benzhydryl-6-(iodomethyl)-4-methyl-2-oxo-1,3-diazinane-1-carboxylate Traditional Name: (4R,6R)-3-benzhydryl-6-(iodomethyl)-2-keto-4-methyl-hexahydropyrimidine-1-carboxylic acid ethyl ester Formula: C22H25IN2O3 MolecularWeight: 492.34997

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1C(CC(N(C1=O)C(C2=CC=CC=C2)C3=CC=CC=C3)C)CI

Isomeric SMILES

CCOC(=O)N1[C@H](C[C@H](N(C1=O)C(C2=CC=CC=C2)C3=CC=CC=C3)C)CI

InChI

InChI=1S/C22H25IN2O3/c1-3-28-22(27)25-19(15-23)14-16(2)24(21(25)26)20(17-10-6-4-7-11-17)18-12-8-5-9-13-18/h4-13,16,19-20H,3,14-15H2,1-2H3/t16-,19-/m1/s1