cyclohexyl 1-(2-nitramido-1,4,5,6-tetrahydropyrimidin-5-yl)cyclohexane-1-carboxylate

Systemtic Name: cyclohexyl 1-(2-nitramido-1,4,5,6-tetrahydropyrimidin-5-yl)cyclohexane-1-carboxylate Openeye Name: cyclohexyl 1-(2-nitramido-1,4,5,6-tetrahydropyrimidin-5-yl)cyclohexanecarboxylate CAS Name: 1-(2-nitramido-1,4,5,6-tetrahydropyrimidin-5-yl)-1-cyclohexanecarboxylic acid cyclohexyl ester IUPAC Name: cyclohexyl 1-(2-nitramido-1,4,5,6-tetrahydropyrimidin-5-yl)cyclohexane-1-carboxylate Traditional Name: 1-(2-nitramido-1,4,5,6-tetrahydropyrimidin-5-yl)cyclohexanecarboxylic acid cyclohexyl ester Formula: C17H28N4O4 MolecularWeight: 352.42862

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)OC(=O)C2(CCCCC2)C3CNC(=NC3)N[N+](=O)[O-]

Isomeric SMILES

C1CCC(CC1)OC(=O)C2(CCCCC2)C3CNC(=NC3)N[N+](=O)[O-]

InChI

InChI=1S/C17H28N4O4/c22-15(25-14-7-3-1-4-8-14)17(9-5-2-6-10-17)13-11-18-16(19-12-13)20-21(23)24/h13-14H,1-12H2,(H2,18,19,20)