ethyl (4R)-6-[4-(1H-indol-3-yl)butanoyloxymethyl]-4-methyl-2-oxidanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate

Systemtic Name: ethyl (4R)-6-[4-(1H-indol-3-yl)butanoyloxymethyl]-4-methyl-2-oxidanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate Openeye Name: ethyl (4R)-6-[4-(1H-indol-3-yl)butanoyloxymethyl]-4-methyl-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylate CAS Name: (4R)-6-[[4-(1H-indol-3-yl)-1-oxobutoxy]methyl]-4-methyl-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylic acid ethyl ester IUPAC Name: ethyl (4R)-6-[4-(1H-indol-3-yl)butanoyloxymethyl]-4-methyl-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylate Traditional Name: (4R)-6-[4-(1H-indol-3-yl)butanoyloxymethyl]-2-keto-4-methyl-3,4-dihydro-1H-pyrimidine-5-carboxylic acid ethyl ester Formula: C21H25N3O5 MolecularWeight: 399.4403

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(NC(=O)NC1C)COC(=O)CCCC2=CNC3=CC=CC=C32

Isomeric SMILES

CCOC(=O)C1=C(NC(=O)N[C@@H]1C)COC(=O)CCCC2=CNC3=CC=CC=C32

InChI

InChI=1S/C21H25N3O5/c1-3-28-20(26)19-13(2)23-21(27)24-17(19)12-29-18(25)10-6-7-14-11-22-16-9-5-4-8-15(14)16/h4-5,8-9,11,13,22H,3,6-7,10,12H2,1-2H3,(H2,23,24,27)/t13-/m1/s1