3-[3,4-bis(phenylmethoxy)phenyl]-3-oxidanyl-propanenitrile

Systemtic Name: 3-[3,4-bis(phenylmethoxy)phenyl]-3-oxidanyl-propanenitrile Openeye Name: 3-(3,4-dibenzyloxyphenyl)-3-hydroxy-propanenitrile CAS Name: 3-[3,4-bis(phenylmethoxy)phenyl]-3-hydroxypropanenitrile IUPAC Name: 3-[3,4-bis(phenylmethoxy)phenyl]-3-hydroxypropanenitrile Traditional Name: 3-(3,4-dibenzoxyphenyl)-3-hydroxy-propionitrile Formula: C23H21NO3 MolecularWeight: 360.410395

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC2=C(C=C(C=C2)C(CC#N)O)OCC3=CC=CC=C3

Isomeric SMILES

C1=CC=C(C=C1)COC2=C(C=C(C=C2)C(C[13C]#N)O)OCC3=CC=CC=C3

InChI

InChI=1S/C23H21NO3/c24-14-13-21(25)20-11-12-22(26-16-18-7-3-1-4-8-18)23(15-20)27-17-19-9-5-2-6-10-19/h1-12,15,21,25H,13,16-17H2/i14+1