2,6-dimethoxy-4-[[4-(naphthalen-2-ylmethyl)piperazin-1-ium-1-yl]methyl]phenol

Systemtic Name: 2,6-dimethoxy-4-[[4-(naphthalen-2-ylmethyl)piperazin-1-ium-1-yl]methyl]phenol Openeye Name: 2,6-dimethoxy-4-[[4-(2-naphthylmethyl)piperazin-1-ium-1-yl]methyl]phenol CAS Name: 2,6-dimethoxy-4-[[4-(2-naphthalenylmethyl)-1-piperazin-1-iumyl]methyl]phenol IUPAC Name: 2,6-dimethoxy-4-[[4-(naphthalen-2-ylmethyl)piperazin-1-ium-1-yl]methyl]phenol Traditional Name: 2,6-dimethoxy-4-[[4-(2-naphthylmethyl)piperazin-1-ium-1-yl]methyl]phenol Formula: C24H29N2O3+ MolecularWeight: 393.49866

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1O)OC)C[NH+]2CCN(CC2)CC3=CC4=CC=CC=C4C=C3

Isomeric SMILES

COC1=CC(=CC(=C1O)OC)C[NH+]2CCN(CC2)CC3=CC4=CC=CC=C4C=C3

InChI

InChI=1S/C24H28N2O3/c1-28-22-14-19(15-23(29-2)24(22)27)17-26-11-9-25(10-12-26)16-18-7-8-20-5-3-4-6-21(20)13-18/h3-8,13-15,27H,9-12,16-17H2,1-2H3/p+1