4-(4-bromophenyl)-1-(5,8-dimethoxy-4-methyl-quinolin-1-ium-2-yl)piperidin-4-ol

Systemtic Name: 4-(4-bromophenyl)-1-(5,8-dimethoxy-4-methyl-quinolin-1-ium-2-yl)piperidin-4-ol Openeye Name: 4-(4-bromophenyl)-1-(5,8-dimethoxy-4-methyl-quinolin-1-ium-2-yl)piperidin-4-ol CAS Name: 4-(4-bromophenyl)-1-(5,8-dimethoxy-4-methyl-2-quinolin-1-iumyl)-4-piperidinol IUPAC Name: 4-(4-bromophenyl)-1-(5,8-dimethoxy-4-methylquinolin-1-ium-2-yl)piperidin-4-ol Traditional Name: 4-(4-bromophenyl)-1-(5,8-dimethoxy-4-methyl-quinolin-1-ium-2-yl)piperidin-4-ol Formula: C23H26BrN2O3+ MolecularWeight: 458.36814

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=[NH+]C2=C(C=CC(=C12)OC)OC)N3CCC(CC3)(C4=CC=C(C=C4)Br)O

Isomeric SMILES

CC1=CC(=[NH+]C2=C(C=CC(=C12)OC)OC)N3CCC(CC3)(C4=CC=C(C=C4)Br)O

InChI

InChI=1S/C23H25BrN2O3/c1-15-14-20(25-22-19(29-3)9-8-18(28-2)21(15)22)26-12-10-23(27,11-13-26)16-4-6-17(24)7-5-16/h4-9,14,27H,10-13H2,1-3H3/p+1