3-(2-hydroxyethylamino)-2-(1-pyridin-4-ylbutoxy)benzenecarbonitrile

Systemtic Name: 3-(2-hydroxyethylamino)-2-(1-pyridin-4-ylbutoxy)benzenecarbonitrile Openeye Name: 3-(2-hydroxyethylamino)-2-[1-(4-pyridyl)butoxy]benzonitrile CAS Name: 3-(2-hydroxyethylamino)-2-(1-pyridin-4-ylbutoxy)benzonitrile IUPAC Name: 3-(2-hydroxyethylamino)-2-(1-pyridin-4-ylbutoxy)benzonitrile Traditional Name: 3-(2-hydroxyethylamino)-2-[1-(4-pyridyl)butoxy]benzonitrile Formula: C18H21N3O2 MolecularWeight: 311.37824

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C1=CC=NC=C1)OC2=C(C=CC=C2NCCO)C#N

Isomeric SMILES

CCCC(C1=CC=NC=C1)OC2=C(C=CC=C2NCCO)C#N

InChI

InChI=1S/C18H21N3O2/c1-2-4-17(14-7-9-20-10-8-14)23-18-15(13-19)5-3-6-16(18)21-11-12-22/h3,5-10,17,21-22H,2,4,11-12H2,1H3