(2-methyl-2-morpholin-4-yl-propyl)-[[3-phenyl-1-(phenylmethyl)pyrazol-4-yl]methyl]azanium

Systemtic Name: (2-methyl-2-morpholin-4-yl-propyl)-[[3-phenyl-1-(phenylmethyl)pyrazol-4-yl]methyl]azanium Openeye Name: (1-benzyl-3-phenyl-pyrazol-4-yl)methyl-(2-methyl-2-morpholino-propyl)ammonium CAS Name: [2-methyl-2-(4-morpholinyl)propyl]-[[3-phenyl-1-(phenylmethyl)-4-pyrazolyl]methyl]ammonium IUPAC Name: (1-benzyl-3-phenylpyrazol-4-yl)methyl-(2-methyl-2-morpholin-4-ylpropyl)azanium Traditional Name: (1-benzyl-3-phenyl-pyrazol-4-yl)methyl-(2-methyl-2-morpholino-propyl)ammonium Formula: C25H33N4O+ MolecularWeight: 405.55572

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C[NH2+]CC1=CN(N=C1C2=CC=CC=C2)CC3=CC=CC=C3)N4CCOCC4

Isomeric SMILES

CC(C)(C[NH2+]CC1=CN(N=C1C2=CC=CC=C2)CC3=CC=CC=C3)N4CCOCC4

InChI

InChI=1S/C25H32N4O/c1-25(2,28-13-15-30-16-14-28)20-26-17-23-19-29(18-21-9-5-3-6-10-21)27-24(23)22-11-7-4-8-12-22/h3-12,19,26H,13-18,20H2,1-2H3/p+1