oxolan-2-ylmethyl 4-methylidene-6-(3-nitrophenyl)-2-oxidanylidene-1,3-diazinane-5-carboxylate

Systemtic Name: oxolan-2-ylmethyl 4-methylidene-6-(3-nitrophenyl)-2-oxidanylidene-1,3-diazinane-5-carboxylate Openeye Name: tetrahydrofuran-2-ylmethyl 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 2-oxolanylmethyl ester IUPAC Name: oxolan-2-ylmethyl 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 tetrahydrofurfuryl ester Formula: C17H19N3O6 MolecularWeight: 361.34926

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Descriptors Computed from Structure

Canonical SMILES:

C=C1C(C(NC(=O)N1)C2=CC(=CC=C2)[N+](=O)[O-])C(=O)OCC3CCCO3

Isomeric SMILES

C=C1C(C(NC(=O)N1)C2=CC(=CC=C2)[N+](=O)[O-])C(=O)OCC3CCCO3

InChI

InChI=1S/C17H19N3O6/c1-10-14(16(21)26-9-13-6-3-7-25-13)15(19-17(22)18-10)11-4-2-5-12(8-11)20(23)24/h2,4-5,8,13-15H,1,3,6-7,9H2,(H2,18,19,22)