[7-chloranyl-2-oxidanylidene-1-(pyridin-2-ylmethyl)quinolin-3-yl]methyl-(2-methoxy-2-methyl-propyl)azanium

Systemtic Name: [7-chloranyl-2-oxidanylidene-1-(pyridin-2-ylmethyl)quinolin-3-yl]methyl-(2-methoxy-2-methyl-propyl)azanium Openeye Name: [7-chloro-2-oxo-1-(2-pyridylmethyl)-3-quinolyl]methyl-(2-methoxy-2-methyl-propyl)ammonium CAS Name: [7-chloro-2-oxo-1-(2-pyridinylmethyl)-3-quinolinyl]methyl-(2-methoxy-2-methylpropyl)ammonium IUPAC Name: [7-chloro-2-oxo-1-(pyridin-2-ylmethyl)quinolin-3-yl]methyl-(2-methoxy-2-methylpropyl)azanium Traditional Name: [7-chloro-2-keto-1-(2-pyridylmethyl)-3-quinolyl]methyl-(2-methoxy-2-methyl-propyl)ammonium Formula: C21H25ClN3O2+ MolecularWeight: 386.8951

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C[NH2+]CC1=CC2=C(C=C(C=C2)Cl)N(C1=O)CC3=CC=CC=N3)OC

Isomeric SMILES

CC(C)(C[NH2+]CC1=CC2=C(C=C(C=C2)Cl)N(C1=O)CC3=CC=CC=N3)OC

InChI

InChI=1S/C21H24ClN3O2/c1-21(2,27-3)14-23-12-16-10-15-7-8-17(22)11-19(15)25(20(16)26)13-18-6-4-5-9-24-18/h4-11,23H,12-14H2,1-3H3/p+1