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

Systemtic Name: 1-[(3-methoxyphenyl)methyl]-4-[1-(phenylmethyl)piperidin-1-ium-4-yl]piperazin-1-ium Openeye Name: 1-(1-benzylpiperidin-1-ium-4-yl)-4-[(3-methoxyphenyl)methyl]piperazin-4-ium CAS Name: 1-[(3-methoxyphenyl)methyl]-4-[1-(phenylmethyl)-4-piperidin-1-iumyl]piperazin-1-ium IUPAC Name: 1-(1-benzylpiperidin-1-ium-4-yl)-4-[(3-methoxyphenyl)methyl]piperazin-4-ium Traditional Name: 1-(1-benzylpiperidin-1-ium-4-yl)-4-m-anisyl-piperazin-4-ium Formula: C24H35N3O+2 MolecularWeight: 381.5542

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)C[NH+]2CCN(CC2)C3CC[NH+](CC3)CC4=CC=CC=C4

Isomeric SMILES

COC1=CC=CC(=C1)C[NH+]2CCN(CC2)C3CC[NH+](CC3)CC4=CC=CC=C4

InChI

InChI=1S/C24H33N3O/c1-28-24-9-5-8-22(18-24)20-26-14-16-27(17-15-26)23-10-12-25(13-11-23)19-21-6-3-2-4-7-21/h2-9,18,23H,10-17,19-20H2,1H3/p+2