dimethyl-[2-[[(3S)-1,2,3,4-tetrahydroisoquinolin-2-ium-3-yl]carbonylamino]ethyl]azanium

Systemtic Name: dimethyl-[2-[[(3S)-1,2,3,4-tetrahydroisoquinolin-2-ium-3-yl]carbonylamino]ethyl]azanium Openeye Name: dimethyl-[2-[[(3S)-1,2,3,4-tetrahydroisoquinolin-2-ium-3-carbonyl]amino]ethyl]ammonium CAS Name: dimethyl-[2-[[oxo-[(3S)-1,2,3,4-tetrahydroisoquinolin-2-ium-3-yl]methyl]amino]ethyl]ammonium IUPAC Name: dimethyl-[2-[[(3S)-1,2,3,4-tetrahydroisoquinolin-2-ium-3-carbonyl]amino]ethyl]azanium Traditional Name: dimethyl-[2-[[(3S)-1,2,3,4-tetrahydroisoquinolin-2-ium-3-carbonyl]amino]ethyl]ammonium Formula: C14H23N3O+2 MolecularWeight: 249.35192

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C[NH+](C)CCNC(=O)C1CC2=CC=CC=C2C[NH2+]1

Isomeric SMILES

C[NH+](C)CCNC(=O)[C@@H]1CC2=CC=CC=C2C[NH2+]1

InChI

InChI=1S/C14H21N3O/c1-17(2)8-7-15-14(18)13-9-11-5-3-4-6-12(11)10-16-13/h3-6,13,16H,7-10H2,1-2H3,(H,15,18)/p+2/t13-/m0/s1