3-[(5-azanyl-2-oxidanyl-phenyl)methylamino]benzenecarbonitrile

Systemtic Name: 3-[(5-azanyl-2-oxidanyl-phenyl)methylamino]benzenecarbonitrile Openeye Name: 3-[(5-amino-2-hydroxy-phenyl)methylamino]benzonitrile CAS Name: 3-[(5-amino-2-hydroxyphenyl)methylamino]benzonitrile IUPAC Name: 3-[(5-amino-2-hydroxyphenyl)methylamino]benzonitrile Traditional Name: 3-[(5-amino-2-hydroxy-benzyl)amino]benzonitrile Formula: C14H13N3O MolecularWeight: 239.27252

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)NCC2=C(C=CC(=C2)N)O)C#N

Isomeric SMILES

C1=CC(=CC(=C1)NCC2=C(C=CC(=C2)N)O)C#N

InChI

InChI=1S/C14H13N3O/c15-8-10-2-1-3-13(6-10)17-9-11-7-12(16)4-5-14(11)18/h1-7,17-18H,9,16H2