5-ethynyl-3,3-dimethyl-1-quinolin-3-yl-4H-isoquinoline

Systemtic Name: 5-ethynyl-3,3-dimethyl-1-quinolin-3-yl-4H-isoquinoline Openeye Name: 5-ethynyl-3,3-dimethyl-1-(3-quinolyl)-4H-isoquinoline CAS Name: 5-ethynyl-3,3-dimethyl-1-(3-quinolinyl)-4H-isoquinoline IUPAC Name: 5-ethynyl-3,3-dimethyl-1-quinolin-3-yl-4H-isoquinoline Traditional Name: 5-ethynyl-3,3-dimethyl-1-(3-quinolyl)-4H-isoquinoline Formula: C22H18N2 MolecularWeight: 310.39172

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC2=C(C=CC=C2C(=N1)C3=CC4=CC=CC=C4N=C3)C#C)C

Isomeric SMILES

CC1(CC2=C(C=CC=C2C(=N1)C3=CC4=CC=CC=C4N=C3)C#C)C

InChI

InChI=1S/C22H18N2/c1-4-15-9-7-10-18-19(15)13-22(2,3)24-21(18)17-12-16-8-5-6-11-20(16)23-14-17/h1,5-12,14H,13H2,2-3H3