3-[2-[3-[3-(dimethylamino)propoxy]-6-methyl-pyridin-2-yl]ethynyl]benzenecarbonitrile

Systemtic Name: 3-[2-[3-[3-(dimethylamino)propoxy]-6-methyl-pyridin-2-yl]ethynyl]benzenecarbonitrile Openeye Name: 3-[2-[3-[3-(dimethylamino)propoxy]-6-methyl-2-pyridyl]ethynyl]benzonitrile CAS Name: 3-[2-[3-[3-(dimethylamino)propoxy]-6-methyl-2-pyridinyl]ethynyl]benzonitrile IUPAC Name: 3-[2-[3-[3-(dimethylamino)propoxy]-6-methylpyridin-2-yl]ethynyl]benzonitrile Traditional Name: 3-[2-[3-[3-(dimethylamino)propoxy]-6-methyl-2-pyridyl]ethynyl]benzonitrile Formula: C20H21N3O MolecularWeight: 319.40024

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=C(C=C1)OCCCN(C)C)C#CC2=CC(=CC=C2)C#N

Isomeric SMILES

CC1=NC(=C(C=C1)OCCCN(C)C)C#CC2=CC(=CC=C2)C#N

InChI

InChI=1S/C20H21N3O/c1-16-8-11-20(24-13-5-12-23(2)3)19(22-16)10-9-17-6-4-7-18(14-17)15-21/h4,6-8,11,14H,5,12-13H2,1-3H3