4-[1-[1-(5-methyl-2-oxidanyl-phenyl)ethylamino]ethyl]benzenecarbonitrile

Systemtic Name: 4-[1-[1-(5-methyl-2-oxidanyl-phenyl)ethylamino]ethyl]benzenecarbonitrile Openeye Name: 4-[1-[1-(2-hydroxy-5-methyl-phenyl)ethylamino]ethyl]benzonitrile CAS Name: 4-[1-[1-(2-hydroxy-5-methylphenyl)ethylamino]ethyl]benzonitrile IUPAC Name: 4-[1-[1-(2-hydroxy-5-methylphenyl)ethylamino]ethyl]benzonitrile Traditional Name: 4-[1-[1-(2-hydroxy-5-methyl-phenyl)ethylamino]ethyl]benzonitrile Formula: C18H20N2O MolecularWeight: 280.3642

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)O)C(C)NC(C)C2=CC=C(C=C2)C#N

Isomeric SMILES

CC1=CC(=C(C=C1)O)C(C)NC(C)C2=CC=C(C=C2)C#N

InChI

InChI=1S/C18H20N2O/c1-12-4-9-18(21)17(10-12)14(3)20-13(2)16-7-5-15(11-19)6-8-16/h4-10,13-14,20-21H,1-3H3