[2-[(5-cyclopropyl-2-phenyl-pyrazol-3-yl)amino]-2-oxidanylidene-ethyl]-methyl-(phenylmethyl)azanium

Systemtic Name: [2-[(5-cyclopropyl-2-phenyl-pyrazol-3-yl)amino]-2-oxidanylidene-ethyl]-methyl-(phenylmethyl)azanium Openeye Name: benzyl-[2-[(5-cyclopropyl-2-phenyl-pyrazol-3-yl)amino]-2-oxo-ethyl]-methyl-ammonium CAS Name: [2-[(5-cyclopropyl-2-phenyl-3-pyrazolyl)amino]-2-oxoethyl]-methyl-(phenylmethyl)ammonium IUPAC Name: benzyl-[2-[(5-cyclopropyl-2-phenylpyrazol-3-yl)amino]-2-oxoethyl]-methylazanium Traditional Name: benzyl-[2-[(5-cyclopropyl-2-phenyl-pyrazol-3-yl)amino]-2-keto-ethyl]-methyl-ammonium Formula: C22H25N4O+ MolecularWeight: 361.4601

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](CC1=CC=CC=C1)CC(=O)NC2=CC(=NN2C3=CC=CC=C3)C4CC4

Isomeric SMILES

C[NH+](CC1=CC=CC=C1)CC(=O)NC2=CC(=NN2C3=CC=CC=C3)C4CC4

InChI

InChI=1S/C22H24N4O/c1-25(15-17-8-4-2-5-9-17)16-22(27)23-21-14-20(18-12-13-18)24-26(21)19-10-6-3-7-11-19/h2-11,14,18H,12-13,15-16H2,1H3,(H,23,27)/p+1