1-methyl-3-[[1-(4-nitrophenyl)pyrrolidin-2-yl]methyl]imidazol-1-ium

Systemtic Name: 1-methyl-3-[[1-(4-nitrophenyl)pyrrolidin-2-yl]methyl]imidazol-1-ium Openeye Name: 1-methyl-3-[[1-(4-nitrophenyl)pyrrolidin-2-yl]methyl]imidazol-1-ium CAS Name: 1-methyl-3-[[1-(4-nitrophenyl)-2-pyrrolidinyl]methyl]imidazol-1-ium IUPAC Name: 1-methyl-3-[[1-(4-nitrophenyl)pyrrolidin-2-yl]methyl]imidazol-1-ium Traditional Name: 1-methyl-3-[[1-(4-nitrophenyl)pyrrolidin-2-yl]methyl]imidazol-1-ium Formula: C15H19N4O2+ MolecularWeight: 287.33696

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Descriptors Computed from Structure

Canonical SMILES:

C[N+]1=CN(C=C1)CC2CCCN2C3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

C[N+]1=CN(C=C1)CC2CCCN2C3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C15H19N4O2/c1-16-9-10-17(12-16)11-15-3-2-8-18(15)13-4-6-14(7-5-13)19(20)21/h4-7,9-10,12,15H,2-3,8,11H2,1H3/q+1