4-[(1S,2S)-1-[(4-methoxyphenyl)amino]-2-methyl-3-oxidanyl-propyl]benzenecarbonitrile

Systemtic Name: 4-[(1S,2S)-1-[(4-methoxyphenyl)amino]-2-methyl-3-oxidanyl-propyl]benzenecarbonitrile Openeye Name: 4-[(1S,2S)-3-hydroxy-1-(4-methoxyanilino)-2-methyl-propyl]benzonitrile CAS Name: 4-[(1S,2S)-3-hydroxy-1-(4-methoxyanilino)-2-methylpropyl]benzonitrile IUPAC Name: 4-[(1S,2S)-3-hydroxy-1-(4-methoxyanilino)-2-methylpropyl]benzonitrile Traditional Name: 4-[(1S,2S)-3-hydroxy-2-methyl-1-(p-anisidino)propyl]benzonitrile Formula: C18H20N2O2 MolecularWeight: 296.3636

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Descriptors Computed from Structure

Canonical SMILES:

CC(CO)C(C1=CC=C(C=C1)C#N)NC2=CC=C(C=C2)OC

Isomeric SMILES

C[C@H](CO)[C@@H](C1=CC=C(C=C1)C#N)NC2=CC=C(C=C2)OC

InChI

InChI=1S/C18H20N2O2/c1-13(12-21)18(15-5-3-14(11-19)4-6-15)20-16-7-9-17(22-2)10-8-16/h3-10,13,18,20-21H,12H2,1-2H3/t13-,18+/m1/s1