(5-chloranyl-3-methyl-1-phenyl-pyrazol-4-yl)methyl-[(3,4-dimethoxyphenyl)methyl]-methyl-azanium

Systemtic Name: (5-chloranyl-3-methyl-1-phenyl-pyrazol-4-yl)methyl-[(3,4-dimethoxyphenyl)methyl]-methyl-azanium Openeye Name: (5-chloro-3-methyl-1-phenyl-pyrazol-4-yl)methyl-[(3,4-dimethoxyphenyl)methyl]-methyl-ammonium CAS Name: (5-chloro-3-methyl-1-phenyl-4-pyrazolyl)methyl-[(3,4-dimethoxyphenyl)methyl]-methylammonium IUPAC Name: (5-chloro-3-methyl-1-phenylpyrazol-4-yl)methyl-[(3,4-dimethoxyphenyl)methyl]-methylazanium Traditional Name: (5-chloro-3-methyl-1-phenyl-pyrazol-4-yl)methyl-methyl-veratryl-ammonium Formula: C21H25ClN3O2+ MolecularWeight: 386.8951

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1C[NH+](C)CC2=CC(=C(C=C2)OC)OC)Cl)C3=CC=CC=C3

Isomeric SMILES

CC1=NN(C(=C1C[NH+](C)CC2=CC(=C(C=C2)OC)OC)Cl)C3=CC=CC=C3

InChI

InChI=1S/C21H24ClN3O2/c1-15-18(21(22)25(23-15)17-8-6-5-7-9-17)14-24(2)13-16-10-11-19(26-3)20(12-16)27-4/h5-12H,13-14H2,1-4H3/p+1