2-(4-tert-butylphenoxy)-4-(dimethylamino)pyridin-1-ium-3-carbonitrile

Systemtic Name: 2-(4-tert-butylphenoxy)-4-(dimethylamino)pyridin-1-ium-3-carbonitrile Openeye Name: 2-(4-tert-butylphenoxy)-4-(dimethylamino)pyridin-1-ium-3-carbonitrile CAS Name: 2-(4-tert-butylphenoxy)-4-(dimethylamino)-3-pyridin-1-iumcarbonitrile IUPAC Name: 2-(4-tert-butylphenoxy)-4-(dimethylamino)pyridin-1-ium-3-carbonitrile Traditional Name: 2-(4-tert-butylphenoxy)-4-(dimethylamino)pyridin-1-ium-3-carbonitrile Formula: C18H22N3O+ MolecularWeight: 296.38678

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)OC2=[NH+]C=CC(=C2C#N)N(C)C

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)OC2=[NH+]C=CC(=C2C#N)N(C)C

InChI

InChI=1S/C18H21N3O/c1-18(2,3)13-6-8-14(9-7-13)22-17-15(12-19)16(21(4)5)10-11-20-17/h6-11H,1-5H3/p+1