(2-chloranyl-7,8-dimethyl-quinolin-3-yl)methyl-methyl-[[4-(methylcarbamoyl)phenyl]methyl]azanium

Systemtic Name: (2-chloranyl-7,8-dimethyl-quinolin-3-yl)methyl-methyl-[[4-(methylcarbamoyl)phenyl]methyl]azanium Openeye Name: (2-chloro-7,8-dimethyl-3-quinolyl)methyl-methyl-[[4-(methylcarbamoyl)phenyl]methyl]ammonium CAS Name: (2-chloro-7,8-dimethyl-3-quinolinyl)methyl-methyl-[[4-(methylcarbamoyl)phenyl]methyl]ammonium IUPAC Name: (2-chloro-7,8-dimethylquinolin-3-yl)methyl-methyl-[[4-(methylcarbamoyl)phenyl]methyl]azanium Traditional Name: (2-chloro-7,8-dimethyl-3-quinolyl)methyl-methyl-[4-(methylcarbamoyl)benzyl]ammonium Formula: C22H25ClN3O+ MolecularWeight: 382.9064

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=NC(=C(C=C2C=C1)C[NH+](C)CC3=CC=C(C=C3)C(=O)NC)Cl)C

Isomeric SMILES

CC1=C(C2=NC(=C(C=C2C=C1)C[NH+](C)CC3=CC=C(C=C3)C(=O)NC)Cl)C

InChI

InChI=1S/C22H24ClN3O/c1-14-5-8-18-11-19(21(23)25-20(18)15(14)2)13-26(4)12-16-6-9-17(10-7-16)22(27)24-3/h5-11H,12-13H2,1-4H3,(H,24,27)/p+1