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

Systemtic Name: 4-[[4-(4-methoxyphenyl)piperazin-1-ium-1-yl]methyl]-2-methyl-aniline Openeye Name: 4-[[4-(4-methoxyphenyl)piperazin-1-ium-1-yl]methyl]-2-methyl-aniline CAS Name: 4-[[4-(4-methoxyphenyl)-1-piperazin-1-iumyl]methyl]-2-methylaniline IUPAC Name: 4-[[4-(4-methoxyphenyl)piperazin-1-ium-1-yl]methyl]-2-methylaniline Traditional Name: [4-[[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(=C1)C[NH+]2CCN(CC2)C3=CC=C(C=C3)OC)N

Isomeric SMILES

CC1=C(C=CC(=C1)C[NH+]2CCN(CC2)C3=CC=C(C=C3)OC)N

InChI

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