1-[[1-(2-methoxyphenyl)pyrrol-2-yl]methyl]-4-(phenylmethyl)piperazin-1-ium

Systemtic Name: 1-[[1-(2-methoxyphenyl)pyrrol-2-yl]methyl]-4-(phenylmethyl)piperazin-1-ium Openeye Name: 1-benzyl-4-[[1-(2-methoxyphenyl)pyrrol-2-yl]methyl]piperazin-4-ium CAS Name: 1-[[1-(2-methoxyphenyl)-2-pyrrolyl]methyl]-4-(phenylmethyl)piperazin-1-ium IUPAC Name: 1-benzyl-4-[[1-(2-methoxyphenyl)pyrrol-2-yl]methyl]piperazin-4-ium Traditional Name: 1-benzyl-4-[[1-(2-methoxyphenyl)pyrrol-2-yl]methyl]piperazin-4-ium Formula: C23H28N3O+ MolecularWeight: 362.48792

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1N2C=CC=C2C[NH+]3CCN(CC3)CC4=CC=CC=C4

Isomeric SMILES

COC1=CC=CC=C1N2C=CC=C2C[NH+]3CCN(CC3)CC4=CC=CC=C4

InChI

InChI=1S/C23H27N3O/c1-27-23-12-6-5-11-22(23)26-13-7-10-21(26)19-25-16-14-24(15-17-25)18-20-8-3-2-4-9-20/h2-13H,14-19H2,1H3/p+1