(1S,3R)-1-(4-methoxyphenyl)-4-methyl-pentane-1,3-diamine

Systemtic Name: (1S,3R)-1-(4-methoxyphenyl)-4-methyl-pentane-1,3-diamine Openeye Name: (1S,3R)-1-(4-methoxyphenyl)-4-methyl-pentane-1,3-diamine CAS Name: (1S,3R)-1-(4-methoxyphenyl)-4-methylpentane-1,3-diamine IUPAC Name: (1S,3R)-1-(4-methoxyphenyl)-4-methylpentane-1,3-diamine Traditional Name: [(1R,3S)-3-amino-1-isopropyl-3-(4-methoxyphenyl)propyl]amine Formula: C13H22N2O MolecularWeight: 222.32658

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(CC(C1=CC=C(C=C1)OC)N)N

Isomeric SMILES

CC(C)[C@@H](C[C@@H](C1=CC=C(C=C1)OC)N)N

InChI

InChI=1S/C13H22N2O/c1-9(2)12(14)8-13(15)10-4-6-11(16-3)7-5-10/h4-7,9,12-13H,8,14-15H2,1-3H3/t12-,13+/m1/s1