1-[1-[(4-methoxyphenyl)methyl]piperidin-1-ium-4-yl]-4-methyl-piperazine-1,4-diium

Systemtic Name: 1-[1-[(4-methoxyphenyl)methyl]piperidin-1-ium-4-yl]-4-methyl-piperazine-1,4-diium Openeye Name: 1-[1-[(4-methoxyphenyl)methyl]piperidin-1-ium-4-yl]-4-methyl-piperazine-1,4-diium CAS Name: 1-[1-[(4-methoxyphenyl)methyl]-4-piperidin-1-iumyl]-4-methylpiperazine-1,4-diium IUPAC Name: 1-[1-[(4-methoxyphenyl)methyl]piperidin-1-ium-4-yl]-4-methylpiperazine-1,4-diium Traditional Name: 1-methyl-4-(1-p-anisylpiperidin-1-ium-4-yl)piperazine-1,4-diium Formula: C18H32N3O+3 MolecularWeight: 306.46618

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CC[NH+](CC1)C2CC[NH+](CC2)CC3=CC=C(C=C3)OC

Isomeric SMILES

C[NH+]1CC[NH+](CC1)C2CC[NH+](CC2)CC3=CC=C(C=C3)OC

InChI

InChI=1S/C18H29N3O/c1-19-11-13-21(14-12-19)17-7-9-20(10-8-17)15-16-3-5-18(22-2)6-4-16/h3-6,17H,7-15H2,1-2H3/p+3