[4-[(1,5-dimethyl-3-oxidanylidene-2-phenyl-pyrazol-4-yl)amino]phenyl]methyl-(2-methyl-2-morpholin-4-yl-propyl)azanium

Systemtic Name: [4-[(1,5-dimethyl-3-oxidanylidene-2-phenyl-pyrazol-4-yl)amino]phenyl]methyl-(2-methyl-2-morpholin-4-yl-propyl)azanium Openeye Name: [4-[(1,5-dimethyl-3-oxo-2-phenyl-pyrazol-4-yl)amino]phenyl]methyl-(2-methyl-2-morpholino-propyl)ammonium CAS Name: [4-[(1,5-dimethyl-3-oxo-2-phenyl-4-pyrazolyl)amino]phenyl]methyl-[2-methyl-2-(4-morpholinyl)propyl]ammonium IUPAC Name: [4-[(1,5-dimethyl-3-oxo-2-phenylpyrazol-4-yl)amino]phenyl]methyl-(2-methyl-2-morpholin-4-ylpropyl)azanium Traditional Name: [4-[(3-keto-1,5-dimethyl-2-phenyl-3-pyrazolin-4-yl)amino]benzyl]-(2-methyl-2-morpholino-propyl)ammonium Formula: C26H36N5O2+ MolecularWeight: 450.59634

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)N(N1C)C2=CC=CC=C2)NC3=CC=C(C=C3)C[NH2+]CC(C)(C)N4CCOCC4

Isomeric SMILES

CC1=C(C(=O)N(N1C)C2=CC=CC=C2)NC3=CC=C(C=C3)C[NH2+]CC(C)(C)N4CCOCC4

InChI

InChI=1S/C26H35N5O2/c1-20-24(25(32)31(29(20)4)23-8-6-5-7-9-23)28-22-12-10-21(11-13-22)18-27-19-26(2,3)30-14-16-33-17-15-30/h5-13,27-28H,14-19H2,1-4H3/p+1