[2-[2-[(1,3-dimethylpyrazol-4-yl)methylamino]-2-oxidanylidene-ethoxy]-5-phenyl-phenyl]methyl-dimethyl-azanium

Systemtic Name: [2-[2-[(1,3-dimethylpyrazol-4-yl)methylamino]-2-oxidanylidene-ethoxy]-5-phenyl-phenyl]methyl-dimethyl-azanium Openeye Name: [2-[2-[(1,3-dimethylpyrazol-4-yl)methylamino]-2-oxo-ethoxy]-5-phenyl-phenyl]methyl-dimethyl-ammonium CAS Name: [2-[2-[(1,3-dimethyl-4-pyrazolyl)methylamino]-2-oxoethoxy]-5-phenylphenyl]methyl-dimethylammonium IUPAC Name: [2-[2-[(1,3-dimethylpyrazol-4-yl)methylamino]-2-oxoethoxy]-5-phenylphenyl]methyl-dimethylazanium Traditional Name: [2-[2-[(1,3-dimethylpyrazol-4-yl)methylamino]-2-keto-ethoxy]-5-phenyl-benzyl]-dimethyl-ammonium Formula: C23H29N4O2+ MolecularWeight: 393.50196

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C=C1CNC(=O)COC2=C(C=C(C=C2)C3=CC=CC=C3)C[NH+](C)C)C

Isomeric SMILES

CC1=NN(C=C1CNC(=O)COC2=C(C=C(C=C2)C3=CC=CC=C3)C[NH+](C)C)C

InChI

InChI=1S/C23H28N4O2/c1-17-21(15-27(4)25-17)13-24-23(28)16-29-22-11-10-19(12-20(22)14-26(2)3)18-8-6-5-7-9-18/h5-12,15H,13-14,16H2,1-4H3,(H,24,28)/p+1