(2R)-1-methyl-2-[5-(4-nitrophenyl)furan-2-yl]-1,3-diazinane-1,3-diium

Systemtic Name: (2R)-1-methyl-2-[5-(4-nitrophenyl)furan-2-yl]-1,3-diazinane-1,3-diium Openeye Name: (2R)-1-methyl-2-[5-(4-nitrophenyl)-2-furyl]hexahydropyrimidine-1,3-diium CAS Name: (2R)-1-methyl-2-[5-(4-nitrophenyl)-2-furanyl]-1,3-diazinane-1,3-diium IUPAC Name: (2R)-1-methyl-2-[5-(4-nitrophenyl)furan-2-yl]-1,3-diazinane-1,3-diium Traditional Name: (2R)-1-methyl-2-[5-(4-nitrophenyl)-2-furyl]hexahydropyrimidine-1,3-diium Formula: C15H19N3O3+2 MolecularWeight: 289.32966

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCC[NH2+]C1C2=CC=C(O2)C3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

C[NH+]1CCC[NH2+][C@H]1C2=CC=C(O2)C3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C15H17N3O3/c1-17-10-2-9-16-15(17)14-8-7-13(21-14)11-3-5-12(6-4-11)18(19)20/h3-8,15-16H,2,9-10H2,1H3/p+2/t15-/m1/s1