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

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

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)C[NH+]2CCC(CC2)N3CC[NH+](CC3)CC4=CC=CC=C4

Isomeric SMILES

COC1=CC=CC(=C1)C[NH+]2CCC(CC2)N3CC[NH+](CC3)CC4=CC=CC=C4

InChI

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