1-[[4-(2,3-dihydro-1-benzofuran-5-ylmethyl)piperazin-4-ium-1-yl]methyl]naphthalen-2-ol

Systemtic Name: 1-[[4-(2,3-dihydro-1-benzofuran-5-ylmethyl)piperazin-4-ium-1-yl]methyl]naphthalen-2-ol Openeye Name: 1-[[4-(2,3-dihydrobenzofuran-5-ylmethyl)piperazin-4-ium-1-yl]methyl]naphthalen-2-ol CAS Name: 1-[[4-(2,3-dihydrobenzofuran-5-ylmethyl)-1-piperazin-4-iumyl]methyl]-2-naphthalenol IUPAC Name: 1-[[4-(2,3-dihydro-1-benzofuran-5-ylmethyl)piperazin-4-ium-1-yl]methyl]naphthalen-2-ol Traditional Name: 1-[[4-(coumaran-5-ylmethyl)piperazin-4-ium-1-yl]methyl]-2-naphthol Formula: C24H27N2O2+ MolecularWeight: 375.48338

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C1C=C(C=C2)C[NH+]3CCN(CC3)CC4=C(C=CC5=CC=CC=C54)O

Isomeric SMILES

C1COC2=C1C=C(C=C2)C[NH+]3CCN(CC3)CC4=C(C=CC5=CC=CC=C54)O

InChI

InChI=1S/C24H26N2O2/c27-23-7-6-19-3-1-2-4-21(19)22(23)17-26-12-10-25(11-13-26)16-18-5-8-24-20(15-18)9-14-28-24/h1-8,15,27H,9-14,16-17H2/p+1