1-(4-methoxyphenyl)-4-[(3S)-1-[(3-methoxyphenyl)methyl]piperidin-3-yl]piperazin-4-ium

Systemtic Name: 1-(4-methoxyphenyl)-4-[(3S)-1-[(3-methoxyphenyl)methyl]piperidin-3-yl]piperazin-4-ium Openeye Name: 1-(4-methoxyphenyl)-4-[(3S)-1-[(3-methoxyphenyl)methyl]-3-piperidyl]piperazin-4-ium CAS Name: 1-(4-methoxyphenyl)-4-[(3S)-1-[(3-methoxyphenyl)methyl]-3-piperidinyl]piperazin-4-ium IUPAC Name: 1-(4-methoxyphenyl)-4-[(3S)-1-[(3-methoxyphenyl)methyl]piperidin-3-yl]piperazin-4-ium Traditional Name: 1-[(3S)-1-m-anisyl-3-piperidyl]-4-(4-methoxyphenyl)piperazin-1-ium Formula: C24H34N3O2+ MolecularWeight: 396.54566

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)N2CC[NH+](CC2)C3CCCN(C3)CC4=CC(=CC=C4)OC

Isomeric SMILES

COC1=CC=C(C=C1)N2CC[NH+](CC2)[C@H]3CCCN(C3)CC4=CC(=CC=C4)OC

InChI

InChI=1S/C24H33N3O2/c1-28-23-10-8-21(9-11-23)26-13-15-27(16-14-26)22-6-4-12-25(19-22)18-20-5-3-7-24(17-20)29-2/h3,5,7-11,17,22H,4,6,12-16,18-19H2,1-2H3/p+1/t22-/m0/s1