(1S)-7-tert-butyl-1-pyridin-3-yl-1,2,3,4-tetrahydroisoquinoline

Systemtic Name: (1S)-7-tert-butyl-1-pyridin-3-yl-1,2,3,4-tetrahydroisoquinoline Openeye Name: (1S)-7-tert-butyl-1-(3-pyridyl)-1,2,3,4-tetrahydroisoquinoline CAS Name: (1S)-7-tert-butyl-1-(3-pyridinyl)-1,2,3,4-tetrahydroisoquinoline IUPAC Name: (1S)-7-tert-butyl-1-pyridin-3-yl-1,2,3,4-tetrahydroisoquinoline Traditional Name: (1S)-7-tert-butyl-1-(3-pyridyl)-1,2,3,4-tetrahydroisoquinoline Formula: C18H22N2 MolecularWeight: 266.38068

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC2=C(CCNC2C3=CN=CC=C3)C=C1

Isomeric SMILES

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

InChI

InChI=1S/C18H22N2/c1-18(2,3)15-7-6-13-8-10-20-17(16(13)11-15)14-5-4-9-19-12-14/h4-7,9,11-12,17,20H,8,10H2,1-3H3/t17-/m1/s1