4-chloranyl-2-[3-[(3-oxidanylpropylamino)methyl]phenoxy]benzenecarbonitrile

Systemtic Name: 4-chloranyl-2-[3-[(3-oxidanylpropylamino)methyl]phenoxy]benzenecarbonitrile Openeye Name: 4-chloro-2-[3-[(3-hydroxypropylamino)methyl]phenoxy]benzonitrile CAS Name: 4-chloro-2-[3-[(3-hydroxypropylamino)methyl]phenoxy]benzonitrile IUPAC Name: 4-chloro-2-[3-[(3-hydroxypropylamino)methyl]phenoxy]benzonitrile Traditional Name: 4-chloro-2-[3-[(3-hydroxypropylamino)methyl]phenoxy]benzonitrile Formula: C17H17ClN2O2 MolecularWeight: 316.78208

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)OC2=C(C=CC(=C2)Cl)C#N)CNCCCO

Isomeric SMILES

C1=CC(=CC(=C1)OC2=C(C=CC(=C2)Cl)C#N)CNCCCO

InChI

InChI=1S/C17H17ClN2O2/c18-15-6-5-14(11-19)17(10-15)22-16-4-1-3-13(9-16)12-20-7-2-8-21/h1,3-6,9-10,20-21H,2,7-8,12H2