N4-(7-chloranylquinolin-4-yl)-1,1,2,2-tetradeuterio-N1-ethyl-pentane-1,4-diamine

Systemtic Name: N4-(7-chloranylquinolin-4-yl)-1,1,2,2-tetradeuterio-N1-ethyl-pentane-1,4-diamine Openeye Name: N4-(7-chloro-4-quinolyl)-1,1,2,2-tetradeuterio-N1-ethyl-pentane-1,4-diamine CAS Name: N4-(7-chloro-4-quinolinyl)-1,1,2,2-tetradeuterio-N1-ethylpentane-1,4-diamine IUPAC Name: 4-N-(7-chloroquinolin-4-yl)-1,1,2,2-tetradeuterio-1-N-ethylpentane-1,4-diamine Traditional Name: (7-chloro-4-quinolyl)-[3,3,4,4-tetradeuterio-4-(ethylamino)-1-methyl-butyl]amine Formula: C16H22ClN3 MolecularWeight: 295.843627

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Descriptors Computed from Structure

Canonical SMILES:

CCNCCCC(C)NC1=C2C=CC(=CC2=NC=C1)Cl

Isomeric SMILES

[2H]C([2H])(CC(C)NC1=C2C=CC(=CC2=NC=C1)Cl)C([2H])([2H])NCC

InChI

InChI=1S/C16H22ClN3/c1-3-18-9-4-5-12(2)20-15-8-10-19-16-11-13(17)6-7-14(15)16/h6-8,10-12,18H,3-5,9H2,1-2H3,(H,19,20)/i4D2,9D2