4-[1-(5-bromanyl-2-oxidanyl-phenyl)propylamino]-2-chloranyl-benzenecarbonitrile

Systemtic Name: 4-[1-(5-bromanyl-2-oxidanyl-phenyl)propylamino]-2-chloranyl-benzenecarbonitrile Openeye Name: 4-[1-(5-bromo-2-hydroxy-phenyl)propylamino]-2-chloro-benzonitrile CAS Name: 4-[1-(5-bromo-2-hydroxyphenyl)propylamino]-2-chlorobenzonitrile IUPAC Name: 4-[1-(5-bromo-2-hydroxyphenyl)propylamino]-2-chlorobenzonitrile Traditional Name: 4-[1-(5-bromo-2-hydroxy-phenyl)propylamino]-2-chloro-benzonitrile Formula: C16H14BrClN2O MolecularWeight: 365.65216

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C1=C(C=CC(=C1)Br)O)NC2=CC(=C(C=C2)C#N)Cl

Isomeric SMILES

CCC(C1=C(C=CC(=C1)Br)O)NC2=CC(=C(C=C2)C#N)Cl

InChI

InChI=1S/C16H14BrClN2O/c1-2-15(13-7-11(17)4-6-16(13)21)20-12-5-3-10(9-19)14(18)8-12/h3-8,15,20-21H,2H2,1H3