2-chloranyl-3-[1-oxidanyl-2-(propan-2-ylamino)ethyl]benzenecarbonitrile

Systemtic Name: 2-chloranyl-3-[1-oxidanyl-2-(propan-2-ylamino)ethyl]benzenecarbonitrile Openeye Name: 2-chloro-3-[1-hydroxy-2-(isopropylamino)ethyl]benzonitrile CAS Name: 2-chloro-3-[1-hydroxy-2-(propan-2-ylamino)ethyl]benzonitrile IUPAC Name: 2-chloro-3-[1-hydroxy-2-(propan-2-ylamino)ethyl]benzonitrile Traditional Name: 2-chloro-3-[1-hydroxy-2-(isopropylamino)ethyl]benzonitrile Formula: C12H15ClN2O MolecularWeight: 238.7133

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NCC(C1=CC=CC(=C1Cl)C#N)O

Isomeric SMILES

CC(C)NCC(C1=CC=CC(=C1Cl)C#N)O

InChI

InChI=1S/C12H15ClN2O/c1-8(2)15-7-11(16)10-5-3-4-9(6-14)12(10)13/h3-5,8,11,15-16H,7H2,1-2H3