(1S)-N-butyl-N-methyl-1-pyridin-4-yl-ethane-1,2-diamine

Systemtic Name: (1S)-N-butyl-N-methyl-1-pyridin-4-yl-ethane-1,2-diamine Openeye Name: (1S)-N-butyl-N-methyl-1-(4-pyridyl)ethane-1,2-diamine CAS Name: (1S)-N-butyl-N-methyl-1-pyridin-4-ylethane-1,2-diamine IUPAC Name: (1S)-N-butyl-N-methyl-1-pyridin-4-ylethane-1,2-diamine Traditional Name: [(1S)-2-amino-1-(4-pyridyl)ethyl]-butyl-methyl-amine Formula: C12H21N3 MolecularWeight: 207.31524

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CCCCN(C)[C@H](CN)C1=CC=NC=C1

InChI

InChI=1S/C12H21N3/c1-3-4-9-15(2)12(10-13)11-5-7-14-8-6-11/h5-8,12H,3-4,9-10,13H2,1-2H3/t12-/m1/s1