2,6-dimethoxy-4-[[4-(4-phenylpiperazin-1-ium-1-yl)piperidin-1-ium-1-yl]methyl]phenol

Systemtic Name: 2,6-dimethoxy-4-[[4-(4-phenylpiperazin-1-ium-1-yl)piperidin-1-ium-1-yl]methyl]phenol Openeye Name: 2,6-dimethoxy-4-[[4-(4-phenylpiperazin-1-ium-1-yl)piperidin-1-ium-1-yl]methyl]phenol CAS Name: 2,6-dimethoxy-4-[[4-(4-phenyl-1-piperazin-1-iumyl)-1-piperidin-1-iumyl]methyl]phenol IUPAC Name: 2,6-dimethoxy-4-[[4-(4-phenylpiperazin-1-ium-1-yl)piperidin-1-ium-1-yl]methyl]phenol Traditional Name: 2,6-dimethoxy-4-[[4-(4-phenylpiperazin-1-ium-1-yl)piperidin-1-ium-1-yl]methyl]phenol Formula: C24H35N3O3+2 MolecularWeight: 413.553

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1O)OC)C[NH+]2CCC(CC2)[NH+]3CCN(CC3)C4=CC=CC=C4

Isomeric SMILES

COC1=CC(=CC(=C1O)OC)C[NH+]2CCC(CC2)[NH+]3CCN(CC3)C4=CC=CC=C4

InChI

InChI=1S/C24H33N3O3/c1-29-22-16-19(17-23(30-2)24(22)28)18-25-10-8-21(9-11-25)27-14-12-26(13-15-27)20-6-4-3-5-7-20/h3-7,16-17,21,28H,8-15,18H2,1-2H3/p+2