[2-[(2-cyclopentylpyrazol-3-yl)amino]-2-oxidanylidene-ethyl]-[(1R)-1-phenylethyl]azanium

Systemtic Name: [2-[(2-cyclopentylpyrazol-3-yl)amino]-2-oxidanylidene-ethyl]-[(1R)-1-phenylethyl]azanium Openeye Name: [2-[(2-cyclopentylpyrazol-3-yl)amino]-2-oxo-ethyl]-[(1R)-1-phenylethyl]ammonium CAS Name: [2-[(2-cyclopentyl-3-pyrazolyl)amino]-2-oxoethyl]-[(1R)-1-phenylethyl]ammonium IUPAC Name: [2-[(2-cyclopentylpyrazol-3-yl)amino]-2-oxoethyl]-[(1R)-1-phenylethyl]azanium Traditional Name: [2-[(2-cyclopentylpyrazol-3-yl)amino]-2-keto-ethyl]-[(1R)-1-phenylethyl]ammonium Formula: C18H25N4O+ MolecularWeight: 313.4173

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC=C1)[NH2+]CC(=O)NC2=CC=NN2C3CCCC3

Isomeric SMILES

C[C@H](C1=CC=CC=C1)[NH2+]CC(=O)NC2=CC=NN2C3CCCC3

InChI

InChI=1S/C18H24N4O/c1-14(15-7-3-2-4-8-15)19-13-18(23)21-17-11-12-20-22(17)16-9-5-6-10-16/h2-4,7-8,11-12,14,16,19H,5-6,9-10,13H2,1H3,(H,21,23)/p+1/t14-/m1/s1