3-[2-[(2,6-dimethylphenoxy)methyl]-1-methyl-piperidin-4-yl]aniline dihydrochloride

Systemtic Name: 3-[2-[(2,6-dimethylphenoxy)methyl]-1-methyl-piperidin-4-yl]aniline dihydrochloride Openeye Name: 3-[2-[(2,6-dimethylphenoxy)methyl]-1-methyl-4-piperidyl]aniline dihydrochloride CAS Name: 3-[2-[(2,6-dimethylphenoxy)methyl]-1-methyl-4-piperidinyl]aniline dihydrochloride IUPAC Name: 3-[2-[(2,6-dimethylphenoxy)methyl]-1-methylpiperidin-4-yl]aniline dihydrochloride Traditional Name: [3-[2-[(2,6-dimethylphenoxy)methyl]-1-methyl-4-piperidyl]phenyl]amine dihydrochloride Formula: C21H30Cl2N2O MolecularWeight: 397.3817

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)C)OCC2CC(CCN2C)C3=CC(=CC=C3)N.Cl.Cl

Isomeric SMILES

CC1=C(C(=CC=C1)C)OCC2CC(CCN2C)C3=CC(=CC=C3)N.Cl.Cl

InChI

InChI=1S/C21H28N2O.2ClH/c1-15-6-4-7-16(2)21(15)24-14-20-13-18(10-11-23(20)3)17-8-5-9-19(22)12-17;;/h4-9,12,18,20H,10-11,13-14,22H2,1-3H3;2*1H