3-[[4-(4-methoxyphenyl)piperazin-1-ium-1-yl]methyl]-2-methyl-aniline

Systemtic Name: 3-[[4-(4-methoxyphenyl)piperazin-1-ium-1-yl]methyl]-2-methyl-aniline Openeye Name: 3-[[4-(4-methoxyphenyl)piperazin-1-ium-1-yl]methyl]-2-methyl-aniline CAS Name: 3-[[4-(4-methoxyphenyl)-1-piperazin-1-iumyl]methyl]-2-methylaniline IUPAC Name: 3-[[4-(4-methoxyphenyl)piperazin-1-ium-1-yl]methyl]-2-methylaniline Traditional Name: [3-[[4-(4-methoxyphenyl)piperazin-1-ium-1-yl]methyl]-2-methyl-phenyl]amine Formula: C19H26N3O+ MolecularWeight: 312.42924

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=C1N)C[NH+]2CCN(CC2)C3=CC=C(C=C3)OC

Isomeric SMILES

CC1=C(C=CC=C1N)C[NH+]2CCN(CC2)C3=CC=C(C=C3)OC

InChI

InChI=1S/C19H25N3O/c1-15-16(4-3-5-19(15)20)14-21-10-12-22(13-11-21)17-6-8-18(23-2)9-7-17/h3-9H,10-14,20H2,1-2H3/p+1