2-(3,5-dimethylpyrazol-1-yl)ethyl-[[2-(4-methoxyphenyl)-7-methyl-quinolin-3-yl]methyl]azanium

Systemtic Name: 2-(3,5-dimethylpyrazol-1-yl)ethyl-[[2-(4-methoxyphenyl)-7-methyl-quinolin-3-yl]methyl]azanium Openeye Name: 2-(3,5-dimethylpyrazol-1-yl)ethyl-[[2-(4-methoxyphenyl)-7-methyl-3-quinolyl]methyl]ammonium CAS Name: 2-(3,5-dimethyl-1-pyrazolyl)ethyl-[[2-(4-methoxyphenyl)-7-methyl-3-quinolinyl]methyl]ammonium IUPAC Name: 2-(3,5-dimethylpyrazol-1-yl)ethyl-[[2-(4-methoxyphenyl)-7-methylquinolin-3-yl]methyl]azanium Traditional Name: 2-(3,5-dimethylpyrazol-1-yl)ethyl-[[2-(4-methoxyphenyl)-7-methyl-3-quinolyl]methyl]ammonium Formula: C25H29N4O+ MolecularWeight: 401.52396

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=NC(=C(C=C2C=C1)C[NH2+]CCN3C(=CC(=N3)C)C)C4=CC=C(C=C4)OC

Isomeric SMILES

CC1=CC2=NC(=C(C=C2C=C1)C[NH2+]CCN3C(=CC(=N3)C)C)C4=CC=C(C=C4)OC

InChI

InChI=1S/C25H28N4O/c1-17-5-6-21-15-22(16-26-11-12-29-19(3)14-18(2)28-29)25(27-24(21)13-17)20-7-9-23(30-4)10-8-20/h5-10,13-15,26H,11-12,16H2,1-4H3/p+1