[(1S)-2-[[1-(3-chlorophenyl)-5-methyl-pyrazol-4-yl]carbonylamino]-1-phenyl-ethyl]-dimethyl-azanium

Systemtic Name: [(1S)-2-[[1-(3-chlorophenyl)-5-methyl-pyrazol-4-yl]carbonylamino]-1-phenyl-ethyl]-dimethyl-azanium Openeye Name: [(1S)-2-[[1-(3-chlorophenyl)-5-methyl-pyrazole-4-carbonyl]amino]-1-phenyl-ethyl]-dimethyl-ammonium CAS Name: [(1S)-2-[[[1-(3-chlorophenyl)-5-methyl-4-pyrazolyl]-oxomethyl]amino]-1-phenylethyl]-dimethylammonium IUPAC Name: [(1S)-2-[[1-(3-chlorophenyl)-5-methylpyrazole-4-carbonyl]amino]-1-phenylethyl]-dimethylazanium Traditional Name: [(1S)-2-[[1-(3-chlorophenyl)-5-methyl-pyrazole-4-carbonyl]amino]-1-phenyl-ethyl]-dimethyl-ammonium Formula: C21H24ClN4O+ MolecularWeight: 383.89446

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=NN1C2=CC(=CC=C2)Cl)C(=O)NCC(C3=CC=CC=C3)[NH+](C)C

Isomeric SMILES

CC1=C(C=NN1C2=CC(=CC=C2)Cl)C(=O)NC[C@H](C3=CC=CC=C3)[NH+](C)C

InChI

InChI=1S/C21H23ClN4O/c1-15-19(13-24-26(15)18-11-7-10-17(22)12-18)21(27)23-14-20(25(2)3)16-8-5-4-6-9-16/h4-13,20H,14H2,1-3H3,(H,23,27)/p+1/t20-/m1/s1