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

Systemtic Name: 4-chloranyl-2-(2-hydroxyethylamino)-3-(1-pyridin-4-ylbutoxy)benzenecarbonitrile Openeye Name: 4-chloro-2-(2-hydroxyethylamino)-3-[1-(4-pyridyl)butoxy]benzonitrile CAS Name: 4-chloro-2-(2-hydroxyethylamino)-3-(1-pyridin-4-ylbutoxy)benzonitrile IUPAC Name: 4-chloro-2-(2-hydroxyethylamino)-3-(1-pyridin-4-ylbutoxy)benzonitrile Traditional Name: 4-chloro-2-(2-hydroxyethylamino)-3-[1-(4-pyridyl)butoxy]benzonitrile Formula: C18H20ClN3O2 MolecularWeight: 345.8233

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H20ClN3O2/c1-2-3-16(13-6-8-21-9-7-13)24-18-15(19)5-4-14(12-20)17(18)22-10-11-23/h4-9,16,22-23H,2-3,10-11H2,1H3