1-[1-[(3,4-dimethoxyphenyl)methyl]piperidin-1-ium-4-yl]-4-phenyl-piperazine

Systemtic Name: 1-[1-[(3,4-dimethoxyphenyl)methyl]piperidin-1-ium-4-yl]-4-phenyl-piperazine Openeye Name: 1-[1-[(3,4-dimethoxyphenyl)methyl]piperidin-1-ium-4-yl]-4-phenyl-piperazine CAS Name: 1-[1-[(3,4-dimethoxyphenyl)methyl]-4-piperidin-1-iumyl]-4-phenylpiperazine IUPAC Name: 1-[1-[(3,4-dimethoxyphenyl)methyl]piperidin-1-ium-4-yl]-4-phenylpiperazine Traditional Name: 1-phenyl-4-(1-veratrylpiperidin-1-ium-4-yl)piperazine Formula: C24H34N3O2+ MolecularWeight: 396.54566

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C[NH+]2CCC(CC2)N3CCN(CC3)C4=CC=CC=C4)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C[NH+]2CCC(CC2)N3CCN(CC3)C4=CC=CC=C4)OC

InChI

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