(3,5-dimethyl-1-propan-2-yl-pyrazol-4-yl)methyl-[(5-methylfuran-2-yl)methyl]-(3-morpholin-4-ium-4-ylpropyl)azanium

Systemtic Name: (3,5-dimethyl-1-propan-2-yl-pyrazol-4-yl)methyl-[(5-methylfuran-2-yl)methyl]-(3-morpholin-4-ium-4-ylpropyl)azanium Openeye Name: (1-isopropyl-3,5-dimethyl-pyrazol-4-yl)methyl-[(5-methyl-2-furyl)methyl]-(3-morpholin-4-ium-4-ylpropyl)ammonium CAS Name: (3,5-dimethyl-1-propan-2-yl-4-pyrazolyl)methyl-[(5-methyl-2-furanyl)methyl]-[3-(4-morpholin-4-iumyl)propyl]ammonium IUPAC Name: (3,5-dimethyl-1-propan-2-ylpyrazol-4-yl)methyl-[(5-methylfuran-2-yl)methyl]-(3-morpholin-4-ium-4-ylpropyl)azanium Traditional Name: (1-isopropyl-3,5-dimethyl-pyrazol-4-yl)methyl-[(5-methyl-2-furyl)methyl]-(3-morpholin-4-ium-4-ylpropyl)ammonium Formula: C22H38N4O2+2 MolecularWeight: 390.56272

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(O1)C[NH+](CCC[NH+]2CCOCC2)CC3=C(N(N=C3C)C(C)C)C

Isomeric SMILES

CC1=CC=C(O1)C[NH+](CCC[NH+]2CCOCC2)CC3=C(N(N=C3C)C(C)C)C

InChI

InChI=1S/C22H36N4O2/c1-17(2)26-20(5)22(19(4)23-26)16-25(15-21-8-7-18(3)28-21)10-6-9-24-11-13-27-14-12-24/h7-8,17H,6,9-16H2,1-5H3/p+2