3,3-dimethylbutan-2-yl 4-methylidene-6-(3-nitrophenyl)-2-oxidanylidene-1,3-diazinane-5-carboxylate

Systemtic Name: 3,3-dimethylbutan-2-yl 4-methylidene-6-(3-nitrophenyl)-2-oxidanylidene-1,3-diazinane-5-carboxylate Openeye Name: 1,2,2-trimethylpropyl 4-methylene-6-(3-nitrophenyl)-2-oxo-hexahydropyrimidine-5-carboxylate CAS Name: 4-methylene-6-(3-nitrophenyl)-2-oxo-1,3-diazinane-5-carboxylic acid 3,3-dimethylbutan-2-yl ester IUPAC Name: 3,3-dimethylbutan-2-yl 4-methylidene-6-(3-nitrophenyl)-2-oxo-1,3-diazinane-5-carboxylate Traditional Name: 2-keto-4-methylene-6-(3-nitrophenyl)hexahydropyrimidine-5-carboxylic acid 1,2,2-trimethylpropyl ester Formula: C18H23N3O5 MolecularWeight: 361.39232

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H23N3O5/c1-10-14(16(22)26-11(2)18(3,4)5)15(20-17(23)19-10)12-7-6-8-13(9-12)21(24)25/h6-9,11,14-15H,1H2,2-5H3,(H2,19,20,23)