2-(4-chloranylphenoxy)ethyl-methyl-[2-[(5-methyl-2-phenyl-pyrazol-3-yl)amino]-2-oxidanylidene-ethyl]azanium

Systemtic Name: 2-(4-chloranylphenoxy)ethyl-methyl-[2-[(5-methyl-2-phenyl-pyrazol-3-yl)amino]-2-oxidanylidene-ethyl]azanium Openeye Name: 2-(4-chlorophenoxy)ethyl-methyl-[2-[(5-methyl-2-phenyl-pyrazol-3-yl)amino]-2-oxo-ethyl]ammonium CAS Name: 2-(4-chlorophenoxy)ethyl-methyl-[2-[(5-methyl-2-phenyl-3-pyrazolyl)amino]-2-oxoethyl]ammonium IUPAC Name: 2-(4-chlorophenoxy)ethyl-methyl-[2-[(5-methyl-2-phenylpyrazol-3-yl)amino]-2-oxoethyl]azanium Traditional Name: 2-(4-chlorophenoxy)ethyl-[2-keto-2-[(5-methyl-2-phenyl-pyrazol-3-yl)amino]ethyl]-methyl-ammonium Formula: C21H24ClN4O2+ MolecularWeight: 399.89386

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1)NC(=O)C[NH+](C)CCOC2=CC=C(C=C2)Cl)C3=CC=CC=C3

Isomeric SMILES

CC1=NN(C(=C1)NC(=O)C[NH+](C)CCOC2=CC=C(C=C2)Cl)C3=CC=CC=C3

InChI

InChI=1S/C21H23ClN4O2/c1-16-14-20(26(24-16)18-6-4-3-5-7-18)23-21(27)15-25(2)12-13-28-19-10-8-17(22)9-11-19/h3-11,14H,12-13,15H2,1-2H3,(H,23,27)/p+1