methyl-[[7-methyl-2-oxidanylidene-1-(pyridin-2-ylmethyl)quinolin-3-yl]methyl]-(2-pyrazol-1-ylethyl)azanium

Systemtic Name: methyl-[[7-methyl-2-oxidanylidene-1-(pyridin-2-ylmethyl)quinolin-3-yl]methyl]-(2-pyrazol-1-ylethyl)azanium Openeye Name: methyl-[[7-methyl-2-oxo-1-(2-pyridylmethyl)-3-quinolyl]methyl]-(2-pyrazol-1-ylethyl)ammonium CAS Name: methyl-[[7-methyl-2-oxo-1-(2-pyridinylmethyl)-3-quinolinyl]methyl]-[2-(1-pyrazolyl)ethyl]ammonium IUPAC Name: methyl-[[7-methyl-2-oxo-1-(pyridin-2-ylmethyl)quinolin-3-yl]methyl]-(2-pyrazol-1-ylethyl)azanium Traditional Name: [2-keto-7-methyl-1-(2-pyridylmethyl)-3-quinolyl]methyl-methyl-(2-pyrazol-1-ylethyl)ammonium Formula: C23H26N5O+ MolecularWeight: 388.48544

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)C=C(C(=O)N2CC3=CC=CC=N3)C[NH+](C)CCN4C=CC=N4

Isomeric SMILES

CC1=CC2=C(C=C1)C=C(C(=O)N2CC3=CC=CC=N3)C[NH+](C)CCN4C=CC=N4

InChI

InChI=1S/C23H25N5O/c1-18-7-8-19-15-20(16-26(2)12-13-27-11-5-10-25-27)23(29)28(22(19)14-18)17-21-6-3-4-9-24-21/h3-11,14-15H,12-13,16-17H2,1-2H3/p+1