ethyl (4S)-4-methyl-6-[(5-nitro-2-oxidanylidene-1,3-benzoxazol-3-yl)methyl]-2-oxidanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate

Systemtic Name: ethyl (4S)-4-methyl-6-[(5-nitro-2-oxidanylidene-1,3-benzoxazol-3-yl)methyl]-2-oxidanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate Openeye Name: ethyl (4S)-4-methyl-6-[(5-nitro-2-oxo-1,3-benzoxazol-3-yl)methyl]-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylate CAS Name: (4S)-4-methyl-6-[(5-nitro-2-oxo-1,3-benzoxazol-3-yl)methyl]-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylic acid ethyl ester IUPAC Name: ethyl (4S)-4-methyl-6-[(5-nitro-2-oxo-1,3-benzoxazol-3-yl)methyl]-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylate Traditional Name: (4S)-2-keto-6-[(2-keto-5-nitro-1,3-benzoxazol-3-yl)methyl]-4-methyl-3,4-dihydro-1H-pyrimidine-5-carboxylic acid ethyl ester Formula: C16H16N4O7 MolecularWeight: 376.32084

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(NC(=O)NC1C)CN2C3=C(C=CC(=C3)[N+](=O)[O-])OC2=O

Isomeric SMILES

CCOC(=O)C1=C(NC(=O)N[C@H]1C)CN2C3=C(C=CC(=C3)[N+](=O)[O-])OC2=O

InChI

InChI=1S/C16H16N4O7/c1-3-26-14(21)13-8(2)17-15(22)18-10(13)7-19-11-6-9(20(24)25)4-5-12(11)27-16(19)23/h4-6,8H,3,7H2,1-2H3,(H2,17,18,22)/t8-/m0/s1