2-azanyl-3-bromanyl-5-[1-(cyclobutylamino)-2-oxidanyl-ethyl]benzenecarbonitrile

Systemtic Name: 2-azanyl-3-bromanyl-5-[1-(cyclobutylamino)-2-oxidanyl-ethyl]benzenecarbonitrile Openeye Name: 2-amino-3-bromo-5-[1-(cyclobutylamino)-2-hydroxy-ethyl]benzonitrile CAS Name: 2-amino-3-bromo-5-[1-(cyclobutylamino)-2-hydroxyethyl]benzonitrile IUPAC Name: 2-amino-3-bromo-5-[1-(cyclobutylamino)-2-hydroxyethyl]benzonitrile Traditional Name: 2-amino-3-bromo-5-[1-(cyclobutylamino)-2-hydroxy-ethyl]benzonitrile Formula: C13H16BrN3O MolecularWeight: 310.18964

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(C1)NC(CO)C2=CC(=C(C(=C2)C#N)N)Br

Isomeric SMILES

C1CC(C1)NC(CO)C2=CC(=C(C(=C2)C#N)N)Br

InChI

InChI=1S/C13H16BrN3O/c14-11-5-8(4-9(6-15)13(11)16)12(7-18)17-10-2-1-3-10/h4-5,10,12,17-18H,1-3,7,16H2