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

Systemtic Name: (1S)-7-propan-2-yl-1-pyridin-3-yl-1,2,3,4-tetrahydroisoquinolin-2-ium Openeye Name: (1S)-7-isopropyl-1-(3-pyridyl)-1,2,3,4-tetrahydroisoquinolin-2-ium CAS Name: (1S)-7-propan-2-yl-1-(3-pyridinyl)-1,2,3,4-tetrahydroisoquinolin-2-ium IUPAC Name: (1S)-7-propan-2-yl-1-pyridin-3-yl-1,2,3,4-tetrahydroisoquinolin-2-ium Traditional Name: (1S)-7-isopropyl-1-(3-pyridyl)-1,2,3,4-tetrahydroisoquinolin-2-ium Formula: C17H21N2+ MolecularWeight: 253.36204

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H20N2/c1-12(2)14-6-5-13-7-9-19-17(16(13)10-14)15-4-3-8-18-11-15/h3-6,8,10-12,17,19H,7,9H2,1-2H3/p+1/t17-/m1/s1