(1S)-7-ethyl-1-pyridin-3-yl-1,2,3,4-tetrahydroisoquinolin-2-ium

Systemtic Name: (1S)-7-ethyl-1-pyridin-3-yl-1,2,3,4-tetrahydroisoquinolin-2-ium Openeye Name: (1S)-7-ethyl-1-(3-pyridyl)-1,2,3,4-tetrahydroisoquinolin-2-ium CAS Name: (1S)-7-ethyl-1-(3-pyridinyl)-1,2,3,4-tetrahydroisoquinolin-2-ium IUPAC Name: (1S)-7-ethyl-1-pyridin-3-yl-1,2,3,4-tetrahydroisoquinolin-2-ium Traditional Name: (1S)-7-ethyl-1-(3-pyridyl)-1,2,3,4-tetrahydroisoquinolin-2-ium Formula: C16H19N2+ MolecularWeight: 239.33546

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC2=C(CC[NH2+]C2C3=CN=CC=C3)C=C1

Isomeric SMILES

CCC1=CC2=C(CC[NH2+][C@@H]2C3=CN=CC=C3)C=C1

InChI

InChI=1S/C16H18N2/c1-2-12-5-6-13-7-9-18-16(15(13)10-12)14-4-3-8-17-11-14/h3-6,8,10-11,16,18H,2,7,9H2,1H3/p+1/t16-/m1/s1