4-[1-[(5-methoxy-2-oxidanyl-phenyl)methylamino]ethyl]benzenecarbonitrile

Systemtic Name: 4-[1-[(5-methoxy-2-oxidanyl-phenyl)methylamino]ethyl]benzenecarbonitrile Openeye Name: 4-[1-[(2-hydroxy-5-methoxy-phenyl)methylamino]ethyl]benzonitrile CAS Name: 4-[1-[(2-hydroxy-5-methoxyphenyl)methylamino]ethyl]benzonitrile IUPAC Name: 4-[1-[(2-hydroxy-5-methoxyphenyl)methylamino]ethyl]benzonitrile Traditional Name: 4-[1-[(2-hydroxy-5-methoxy-benzyl)amino]ethyl]benzonitrile Formula: C17H18N2O2 MolecularWeight: 282.33702

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H18N2O2/c1-12(14-5-3-13(10-18)4-6-14)19-11-15-9-16(21-2)7-8-17(15)20/h3-9,12,19-20H,11H2,1-2H3