2-(4-methoxyphenyl)ethyl-[(1-methylindol-3-yl)methyl]-[(1-methylpiperidin-1-ium-4-yl)methyl]azanium

Systemtic Name: 2-(4-methoxyphenyl)ethyl-[(1-methylindol-3-yl)methyl]-[(1-methylpiperidin-1-ium-4-yl)methyl]azanium Openeye Name: 2-(4-methoxyphenyl)ethyl-[(1-methylindol-3-yl)methyl]-[(1-methylpiperidin-1-ium-4-yl)methyl]ammonium CAS Name: 2-(4-methoxyphenyl)ethyl-[(1-methyl-3-indolyl)methyl]-[(1-methyl-4-piperidin-1-iumyl)methyl]ammonium IUPAC Name: 2-(4-methoxyphenyl)ethyl-[(1-methylindol-3-yl)methyl]-[(1-methylpiperidin-1-ium-4-yl)methyl]azanium Traditional Name: 2-(4-methoxyphenyl)ethyl-[(1-methylindol-3-yl)methyl]-[(1-methylpiperidin-1-ium-4-yl)methyl]ammonium Formula: C26H37N3O+2 MolecularWeight: 407.59148

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCC(CC1)C[NH+](CCC2=CC=C(C=C2)OC)CC3=CN(C4=CC=CC=C43)C

Isomeric SMILES

C[NH+]1CCC(CC1)C[NH+](CCC2=CC=C(C=C2)OC)CC3=CN(C4=CC=CC=C43)C

InChI

InChI=1S/C26H35N3O/c1-27-15-12-22(13-16-27)18-29(17-14-21-8-10-24(30-3)11-9-21)20-23-19-28(2)26-7-5-4-6-25(23)26/h4-11,19,22H,12-18,20H2,1-3H3/p+2