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

Systemtic Name: [2-(aminomethyl)-2-(4-chloranylphenoxy)-3-ethyl-1-methyl-3,4-dihydroquinolin-1-ium-1-yl]-cyclohexyl-methanone Openeye Name: [2-(aminomethyl)-2-(4-chlorophenoxy)-3-ethyl-1-methyl-3,4-dihydroquinolin-1-ium-1-yl]-cyclohexyl-methanone CAS Name: [2-(aminomethyl)-2-(4-chlorophenoxy)-3-ethyl-1-methyl-3,4-dihydroquinolin-1-ium-1-yl]-cyclohexylmethanone IUPAC Name: [2-(aminomethyl)-2-(4-chlorophenoxy)-3-ethyl-1-methyl-3,4-dihydroquinolin-1-ium-1-yl]-cyclohexylmethanone Traditional Name: [2-(aminomethyl)-2-(4-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=C(C=C3)Cl)(C)C(=O)C4CCCCC4

Isomeric SMILES

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

InChI

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