2-methyl-3-[[4-(phenylmethyl)piperidin-1-ium-1-yl]methyl]aniline

Systemtic Name: 2-methyl-3-[[4-(phenylmethyl)piperidin-1-ium-1-yl]methyl]aniline Openeye Name: 3-[(4-benzylpiperidin-1-ium-1-yl)methyl]-2-methyl-aniline CAS Name: 2-methyl-3-[[4-(phenylmethyl)-1-piperidin-1-iumyl]methyl]aniline IUPAC Name: 3-[(4-benzylpiperidin-1-ium-1-yl)methyl]-2-methylaniline Traditional Name: [3-[(4-benzylpiperidin-1-ium-1-yl)methyl]-2-methyl-phenyl]amine Formula: C20H27N2+ MolecularWeight: 295.44178

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=C1N)C[NH+]2CCC(CC2)CC3=CC=CC=C3

Isomeric SMILES

CC1=C(C=CC=C1N)C[NH+]2CCC(CC2)CC3=CC=CC=C3

InChI

InChI=1S/C20H26N2/c1-16-19(8-5-9-20(16)21)15-22-12-10-18(11-13-22)14-17-6-3-2-4-7-17/h2-9,18H,10-15,21H2,1H3/p+1