[2-(aminomethyl)-2-(3-chloranylphenoxy)-3-ethyl-1-methyl-3,4-dihydroquinolin-1-ium-1-yl]-cyclohexyl-methanone

Systemtic Name: [2-(aminomethyl)-2-(3-chloranylphenoxy)-3-ethyl-1-methyl-3,4-dihydroquinolin-1-ium-1-yl]-cyclohexyl-methanone Openeye Name: [2-(aminomethyl)-2-(3-chlorophenoxy)-3-ethyl-1-methyl-3,4-dihydroquinolin-1-ium-1-yl]-cyclohexyl-methanone CAS Name: [2-(aminomethyl)-2-(3-chlorophenoxy)-3-ethyl-1-methyl-3,4-dihydroquinolin-1-ium-1-yl]-cyclohexylmethanone IUPAC Name: [2-(aminomethyl)-2-(3-chlorophenoxy)-3-ethyl-1-methyl-3,4-dihydroquinolin-1-ium-1-yl]-cyclohexylmethanone Traditional Name: [2-(aminomethyl)-2-(3-chlorophenoxy)-3-ethyl-1-methyl-3,4-dihydroquinolin-1-ium-1-yl]-cyclohexyl-methanone Formula: C26H34ClN2O2+ MolecularWeight: 442.01336

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Descriptors Computed from Structure

Canonical SMILES:

CCC1CC2=CC=CC=C2[N+](C1(CN)OC3=CC(=CC=C3)Cl)(C)C(=O)C4CCCCC4

Isomeric SMILES

CCC1CC2=CC=CC=C2[N+](C1(CN)OC3=CC(=CC=C3)Cl)(C)C(=O)C4CCCCC4

InChI

InChI=1S/C26H34ClN2O2/c1-3-21-16-20-12-7-8-15-24(20)29(2,25(30)19-10-5-4-6-11-19)26(21,18-28)31-23-14-9-13-22(27)17-23/h7-9,12-15,17,19,21H,3-6,10-11,16,18,28H2,1-2H3/q+1