trimethyl-[3-[3-[3-[(4-nitrophenyl)amino]propyl]-2H-imidazol-1-yl]-2-oxidanyl-propyl]azanium

Systemtic Name: trimethyl-[3-[3-[3-[(4-nitrophenyl)amino]propyl]-2H-imidazol-1-yl]-2-oxidanyl-propyl]azanium Openeye Name: [2-hydroxy-3-[3-[3-(4-nitroanilino)propyl]-2H-imidazol-1-yl]propyl]-trimethyl-ammonium CAS Name: [2-hydroxy-3-[3-[3-(4-nitroanilino)propyl]-2H-imidazol-1-yl]propyl]-trimethylammonium IUPAC Name: [2-hydroxy-3-[3-[3-(4-nitroanilino)propyl]-2H-imidazol-1-yl]propyl]-trimethylazanium Traditional Name: [2-hydroxy-3-[3-[3-(4-nitroanilino)propyl]-4-imidazolin-1-yl]propyl]-trimethyl-ammonium Formula: C18H30N5O3+ MolecularWeight: 364.4625

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Descriptors Computed from Structure

Canonical SMILES:

C[N+](C)(C)CC(CN1CN(C=C1)CCCNC2=CC=C(C=C2)[N+](=O)[O-])O

Isomeric SMILES

C[N+](C)(C)CC(CN1CN(C=C1)CCCNC2=CC=C(C=C2)[N+](=O)[O-])O

InChI

InChI=1S/C18H30N5O3/c1-23(2,3)14-18(24)13-21-12-11-20(15-21)10-4-9-19-16-5-7-17(8-6-16)22(25)26/h5-8,11-12,18-19,24H,4,9-10,13-15H2,1-3H3/q+1