3-[4-methoxy-3-(5-phenylpentoxy)phenyl]-3-oxidanyl-propanenitrile

Systemtic Name: 3-[4-methoxy-3-(5-phenylpentoxy)phenyl]-3-oxidanyl-propanenitrile Openeye Name: 3-hydroxy-3-[4-methoxy-3-(5-phenylpentoxy)phenyl]propanenitrile CAS Name: 3-hydroxy-3-[4-methoxy-3-(5-phenylpentoxy)phenyl]propanenitrile IUPAC Name: 3-hydroxy-3-[4-methoxy-3-(5-phenylpentoxy)phenyl]propanenitrile Traditional Name: 3-hydroxy-3-[4-methoxy-3-(5-phenylpentoxy)phenyl]propionitrile Formula: C21H25NO3 MolecularWeight: 339.4281

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(CC#N)O)OCCCCCC2=CC=CC=C2

Isomeric SMILES

COC1=C(C=C(C=C1)C(CC#N)O)OCCCCCC2=CC=CC=C2

InChI

InChI=1S/C21H25NO3/c1-24-20-12-11-18(19(23)13-14-22)16-21(20)25-15-7-3-6-10-17-8-4-2-5-9-17/h2,4-5,8-9,11-12,16,19,23H,3,6-7,10,13,15H2,1H3