4-[[ethyl-(phenylmethyl)amino]methyl]-1,5-dimethyl-2-phenyl-pyrazol-3-one hydrochloride

Systemtic Name: 4-[[ethyl-(phenylmethyl)amino]methyl]-1,5-dimethyl-2-phenyl-pyrazol-3-one hydrochloride Openeye Name: 4-[[benzyl(ethyl)amino]methyl]-1,5-dimethyl-2-phenyl-pyrazol-3-one hydrochloride CAS Name: 4-[[ethyl-(phenylmethyl)amino]methyl]-1,5-dimethyl-2-phenyl-3-pyrazolone hydrochloride IUPAC Name: 4-[[benzyl(ethyl)amino]methyl]-1,5-dimethyl-2-phenylpyrazol-3-one hydrochloride Traditional Name: 4-[[benzyl(ethyl)amino]methyl]-1,5-dimethyl-2-phenyl-3-pyrazolin-3-one hydrochloride Formula: C21H26ClN3O MolecularWeight: 371.90364

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC1=CC=CC=C1)CC2=C(N(N(C2=O)C3=CC=CC=C3)C)C.Cl

Isomeric SMILES

CCN(CC1=CC=CC=C1)CC2=C(N(N(C2=O)C3=CC=CC=C3)C)C.Cl

InChI

InChI=1S/C21H25N3O.ClH/c1-4-23(15-18-11-7-5-8-12-18)16-20-17(2)22(3)24(21(20)25)19-13-9-6-10-14-19;/h5-14H,4,15-16H2,1-3H3;1H