N3-[4-(2,2-dimethylpropoxy)phenyl]-2-methyl-N3-(3-methylbutyl)-4-pentyl-piperidine-1,3-diamine

Systemtic Name: N3-[4-(2,2-dimethylpropoxy)phenyl]-2-methyl-N3-(3-methylbutyl)-4-pentyl-piperidine-1,3-diamine Openeye Name: N3-[4-(2,2-dimethylpropoxy)phenyl]-N3-isopentyl-2-methyl-4-pentyl-piperidine-1,3-diamine CAS Name: N3-[4-(2,2-dimethylpropoxy)phenyl]-2-methyl-N3-(3-methylbutyl)-4-pentylpiperidine-1,3-diamine IUPAC Name: 3-N-[4-(2,2-dimethylpropoxy)phenyl]-2-methyl-3-N-(3-methylbutyl)-4-pentylpiperidine-1,3-diamine Traditional Name: (1-amino-4-amyl-2-methyl-3-piperidyl)-isoamyl-(4-neopentyloxyphenyl)amine Formula: C27H49N3O MolecularWeight: 431.69746

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1CCN(C(C1N(CCC(C)C)C2=CC=C(C=C2)OCC(C)(C)C)C)N

Isomeric SMILES

CCCCCC1CCN(C(C1N(CCC(C)C)C2=CC=C(C=C2)OCC(C)(C)C)C)N

InChI

InChI=1S/C27H49N3O/c1-8-9-10-11-23-17-19-30(28)22(4)26(23)29(18-16-21(2)3)24-12-14-25(15-13-24)31-20-27(5,6)7/h12-15,21-23,26H,8-11,16-20,28H2,1-7H3