3-[[5-[(4-chloranylpyrazol-1-yl)methyl]furan-2-yl]carbonylamino]propyl-dimethyl-azanium

Systemtic Name: 3-[[5-[(4-chloranylpyrazol-1-yl)methyl]furan-2-yl]carbonylamino]propyl-dimethyl-azanium Openeye Name: 3-[[5-[(4-chloropyrazol-1-yl)methyl]furan-2-carbonyl]amino]propyl-dimethyl-ammonium CAS Name: 3-[[[5-[(4-chloro-1-pyrazolyl)methyl]-2-furanyl]-oxomethyl]amino]propyl-dimethylammonium IUPAC Name: 3-[[5-[(4-chloropyrazol-1-yl)methyl]furan-2-carbonyl]amino]propyl-dimethylazanium Traditional Name: 3-[[5-[(4-chloropyrazol-1-yl)methyl]-2-furoyl]amino]propyl-dimethyl-ammonium Formula: C14H20ClN4O2+ MolecularWeight: 311.7872

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C[NH+](C)CCCNC(=O)C1=CC=C(O1)CN2C=C(C=N2)Cl

Isomeric SMILES

C[NH+](C)CCCNC(=O)C1=CC=C(O1)CN2C=C(C=N2)Cl

InChI

InChI=1S/C14H19ClN4O2/c1-18(2)7-3-6-16-14(20)13-5-4-12(21-13)10-19-9-11(15)8-17-19/h4-5,8-9H,3,6-7,10H2,1-2H3,(H,16,20)/p+1