diethyl-[3-[[3-(4-pyrrol-1-ylphenyl)-1,2,4-oxadiazol-5-yl]carbonylamino]propyl]azanium

Systemtic Name: diethyl-[3-[[3-(4-pyrrol-1-ylphenyl)-1,2,4-oxadiazol-5-yl]carbonylamino]propyl]azanium Openeye Name: diethyl-[3-[[3-(4-pyrrol-1-ylphenyl)-1,2,4-oxadiazole-5-carbonyl]amino]propyl]ammonium CAS Name: diethyl-[3-[[oxo-[3-[4-(1-pyrrolyl)phenyl]-1,2,4-oxadiazol-5-yl]methyl]amino]propyl]ammonium IUPAC Name: diethyl-[3-[[3-(4-pyrrol-1-ylphenyl)-1,2,4-oxadiazole-5-carbonyl]amino]propyl]azanium Traditional Name: diethyl-[3-[[3-(4-pyrrol-1-ylphenyl)-1,2,4-oxadiazole-5-carbonyl]amino]propyl]ammonium Formula: C20H26N5O2+ MolecularWeight: 368.45274

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC)CCCNC(=O)C1=NC(=NO1)C2=CC=C(C=C2)N3C=CC=C3

Isomeric SMILES

CC[NH+](CC)CCCNC(=O)C1=NC(=NO1)C2=CC=C(C=C2)N3C=CC=C3

InChI

InChI=1S/C20H25N5O2/c1-3-24(4-2)13-7-12-21-19(26)20-22-18(23-27-20)16-8-10-17(11-9-16)25-14-5-6-15-25/h5-6,8-11,14-15H,3-4,7,12-13H2,1-2H3,(H,21,26)/p+1