[(4S)-7-(diethylamino)-1,2,3,4-tetrahydroisoquinolin-2-ium-4-yl]-diethyl-azanium

Systemtic Name: [(4S)-7-(diethylamino)-1,2,3,4-tetrahydroisoquinolin-2-ium-4-yl]-diethyl-azanium Openeye Name: [(4S)-7-(diethylamino)-1,2,3,4-tetrahydroisoquinolin-2-ium-4-yl]-diethyl-ammonium CAS Name: [(4S)-7-(diethylamino)-1,2,3,4-tetrahydroisoquinolin-2-ium-4-yl]-diethylammonium IUPAC Name: [(4S)-7-(diethylamino)-1,2,3,4-tetrahydroisoquinolin-2-ium-4-yl]-diethylazanium Traditional Name: [(4S)-7-(diethylamino)-1,2,3,4-tetrahydroisoquinolin-2-ium-4-yl]-diethyl-ammonium Formula: C17H31N3+2 MolecularWeight: 277.44814

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC)C1C[NH2+]CC2=C1C=CC(=C2)N(CC)CC

Isomeric SMILES

CC[NH+](CC)[C@@H]1C[NH2+]CC2=C1C=CC(=C2)N(CC)CC

InChI

InChI=1S/C17H29N3/c1-5-19(6-2)15-9-10-16-14(11-15)12-18-13-17(16)20(7-3)8-4/h9-11,17-18H,5-8,12-13H2,1-4H3/p+2/t17-/m1/s1