[2-[4-(4-hydroxyphenyl)piperazin-1-yl]-2-oxidanylidene-ethyl]-methyl-[(2-methylphenyl)methyl]azanium

Systemtic Name: [2-[4-(4-hydroxyphenyl)piperazin-1-yl]-2-oxidanylidene-ethyl]-methyl-[(2-methylphenyl)methyl]azanium Openeye Name: [2-[4-(4-hydroxyphenyl)piperazin-1-yl]-2-oxo-ethyl]-methyl-(o-tolylmethyl)ammonium CAS Name: [2-[4-(4-hydroxyphenyl)-1-piperazinyl]-2-oxoethyl]-methyl-[(2-methylphenyl)methyl]ammonium IUPAC Name: [2-[4-(4-hydroxyphenyl)piperazin-1-yl]-2-oxoethyl]-methyl-[(2-methylphenyl)methyl]azanium Traditional Name: [2-[4-(4-hydroxyphenyl)piperazino]-2-keto-ethyl]-methyl-(2-methylbenzyl)ammonium Formula: C21H28N3O2+ MolecularWeight: 354.46592

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C[NH+](C)CC(=O)N2CCN(CC2)C3=CC=C(C=C3)O

Isomeric SMILES

CC1=CC=CC=C1C[NH+](C)CC(=O)N2CCN(CC2)C3=CC=C(C=C3)O

InChI

InChI=1S/C21H27N3O2/c1-17-5-3-4-6-18(17)15-22(2)16-21(26)24-13-11-23(12-14-24)19-7-9-20(25)10-8-19/h3-10,25H,11-16H2,1-2H3/p+1