2-methoxyethyl (5S,6R)-4-methylidene-6-(2-nitrophenyl)-2-oxidanylidene-1,3-diazinane-5-carboxylate

Systemtic Name: 2-methoxyethyl (5S,6R)-4-methylidene-6-(2-nitrophenyl)-2-oxidanylidene-1,3-diazinane-5-carboxylate Openeye Name: 2-methoxyethyl (5S,6R)-4-methylene-6-(2-nitrophenyl)-2-oxo-hexahydropyrimidine-5-carboxylate CAS Name: (5S,6R)-4-methylene-6-(2-nitrophenyl)-2-oxo-1,3-diazinane-5-carboxylic acid 2-methoxyethyl ester IUPAC Name: 2-methoxyethyl (5S,6R)-4-methylidene-6-(2-nitrophenyl)-2-oxo-1,3-diazinane-5-carboxylate Traditional Name: (5S,6R)-2-keto-4-methylene-6-(2-nitrophenyl)hexahydropyrimidine-5-carboxylic acid 2-methoxyethyl ester Formula: C15H17N3O6 MolecularWeight: 335.31198

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Descriptors Computed from Structure

Canonical SMILES:

COCCOC(=O)C1C(NC(=O)NC1=C)C2=CC=CC=C2[N+](=O)[O-]

Isomeric SMILES

COCCOC(=O)[C@H]1[C@@H](NC(=O)NC1=C)C2=CC=CC=C2[N+](=O)[O-]

InChI

InChI=1S/C15H17N3O6/c1-9-12(14(19)24-8-7-23-2)13(17-15(20)16-9)10-5-3-4-6-11(10)18(21)22/h3-6,12-13H,1,7-8H2,2H3,(H2,16,17,20)/t12-,13+/m1/s1