3-[3-[bis(2-hydroxyethyl)amino]-2-(2-cyanoethyl)phenyl]propanenitrile

Systemtic Name: 3-[3-[bis(2-hydroxyethyl)amino]-2-(2-cyanoethyl)phenyl]propanenitrile Openeye Name: 3-[3-[bis(2-hydroxyethyl)amino]-2-(2-cyanoethyl)phenyl]propanenitrile CAS Name: 3-[3-[bis(2-hydroxyethyl)amino]-2-(2-cyanoethyl)phenyl]propanenitrile IUPAC Name: 3-[3-[bis(2-hydroxyethyl)amino]-2-(2-cyanoethyl)phenyl]propanenitrile Traditional Name: 3-[3-[bis(2-hydroxyethyl)amino]-2-(2-cyanoethyl)phenyl]propionitrile Formula: C16H21N3O2 MolecularWeight: 287.35684

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C(=C1)N(CCO)CCO)CCC#N)CCC#N

Isomeric SMILES

C1=CC(=C(C(=C1)N(CCO)CCO)CCC#N)CCC#N

InChI

InChI=1S/C16H21N3O2/c17-8-2-5-14-4-1-7-16(15(14)6-3-9-18)19(10-12-20)11-13-21/h1,4,7,20-21H,2-3,5-6,10-13H2