2-chloranyl-6-[[1-oxidanyl-2-(propan-2-ylamino)ethyl]amino]benzenecarbonitrile

Systemtic Name: 2-chloranyl-6-[[1-oxidanyl-2-(propan-2-ylamino)ethyl]amino]benzenecarbonitrile Openeye Name: 2-chloro-6-[[1-hydroxy-2-(isopropylamino)ethyl]amino]benzonitrile CAS Name: 2-chloro-6-[[1-hydroxy-2-(propan-2-ylamino)ethyl]amino]benzonitrile IUPAC Name: 2-chloro-6-[[1-hydroxy-2-(propan-2-ylamino)ethyl]amino]benzonitrile Traditional Name: 2-chloro-6-[[1-hydroxy-2-(isopropylamino)ethyl]amino]benzonitrile Formula: C12H16ClN3O MolecularWeight: 253.72794

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)NCC(NC1=C(C(=CC=C1)Cl)C#N)O

Isomeric SMILES

CC(C)NCC(NC1=C(C(=CC=C1)Cl)C#N)O

InChI

InChI=1S/C12H16ClN3O/c1-8(2)15-7-12(17)16-11-5-3-4-10(13)9(11)6-14/h3-5,8,12,15-17H,7H2,1-2H3