(2S)-N2-(4-ethoxyphenyl)-3-methyl-butane-1,2-diamine

Systemtic Name: (2S)-N2-(4-ethoxyphenyl)-3-methyl-butane-1,2-diamine Openeye Name: (2S)-N2-(4-ethoxyphenyl)-3-methyl-butane-1,2-diamine CAS Name: (2S)-N2-(4-ethoxyphenyl)-3-methylbutane-1,2-diamine IUPAC Name: (2S)-2-N-(4-ethoxyphenyl)-3-methylbutane-1,2-diamine Traditional Name: [(1S)-1-(aminomethyl)-2-methyl-propyl]-p-phenetyl-amine Formula: C13H22N2O MolecularWeight: 222.32658

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)NC(CN)C(C)C

Isomeric SMILES

CCOC1=CC=C(C=C1)N[C@H](CN)C(C)C

InChI

InChI=1S/C13H22N2O/c1-4-16-12-7-5-11(6-8-12)15-13(9-14)10(2)3/h5-8,10,13,15H,4,9,14H2,1-3H3/t13-/m1/s1