cyclopropyl-[[3-(3-nitrophenyl)-1,2,4-oxadiazol-5-yl]methyl]-(phenylmethyl)azanium

Systemtic Name: cyclopropyl-[[3-(3-nitrophenyl)-1,2,4-oxadiazol-5-yl]methyl]-(phenylmethyl)azanium Openeye Name: benzyl-cyclopropyl-[[3-(3-nitrophenyl)-1,2,4-oxadiazol-5-yl]methyl]ammonium CAS Name: cyclopropyl-[[3-(3-nitrophenyl)-1,2,4-oxadiazol-5-yl]methyl]-(phenylmethyl)ammonium IUPAC Name: benzyl-cyclopropyl-[[3-(3-nitrophenyl)-1,2,4-oxadiazol-5-yl]methyl]azanium Traditional Name: benzyl-cyclopropyl-[[3-(3-nitrophenyl)-1,2,4-oxadiazol-5-yl]methyl]ammonium Formula: C19H19N4O3+ MolecularWeight: 351.37916

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1[NH+](CC2=CC=CC=C2)CC3=NC(=NO3)C4=CC(=CC=C4)[N+](=O)[O-]

Isomeric SMILES

C1CC1[NH+](CC2=CC=CC=C2)CC3=NC(=NO3)C4=CC(=CC=C4)[N+](=O)[O-]

InChI

InChI=1S/C19H18N4O3/c24-23(25)17-8-4-7-15(11-17)19-20-18(26-21-19)13-22(16-9-10-16)12-14-5-2-1-3-6-14/h1-8,11,16H,9-10,12-13H2/p+1