[2-[(2-cyclopentylpyrazol-3-yl)amino]-2-oxidanylidene-ethyl]-methyl-[(2-morpholin-4-ylphenyl)methyl]azanium

Systemtic Name: [2-[(2-cyclopentylpyrazol-3-yl)amino]-2-oxidanylidene-ethyl]-methyl-[(2-morpholin-4-ylphenyl)methyl]azanium Openeye Name: [2-[(2-cyclopentylpyrazol-3-yl)amino]-2-oxo-ethyl]-methyl-[(2-morpholinophenyl)methyl]ammonium CAS Name: [2-[(2-cyclopentyl-3-pyrazolyl)amino]-2-oxoethyl]-methyl-[[2-(4-morpholinyl)phenyl]methyl]ammonium IUPAC Name: [2-[(2-cyclopentylpyrazol-3-yl)amino]-2-oxoethyl]-methyl-[(2-morpholin-4-ylphenyl)methyl]azanium Traditional Name: [2-[(2-cyclopentylpyrazol-3-yl)amino]-2-keto-ethyl]-methyl-(2-morpholinobenzyl)ammonium Formula: C22H32N5O2+ MolecularWeight: 398.52178

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](CC1=CC=CC=C1N2CCOCC2)CC(=O)NC3=CC=NN3C4CCCC4

Isomeric SMILES

C[NH+](CC1=CC=CC=C1N2CCOCC2)CC(=O)NC3=CC=NN3C4CCCC4

InChI

InChI=1S/C22H31N5O2/c1-25(16-18-6-2-5-9-20(18)26-12-14-29-15-13-26)17-22(28)24-21-10-11-23-27(21)19-7-3-4-8-19/h2,5-6,9-11,19H,3-4,7-8,12-17H2,1H3,(H,24,28)/p+1