7-(2-ethanoyl-5-phenylmethoxy-phenoxy)-2-phenyl-heptanenitrile

Systemtic Name: 7-(2-ethanoyl-5-phenylmethoxy-phenoxy)-2-phenyl-heptanenitrile Openeye Name: 7-(2-acetyl-5-benzyloxy-phenoxy)-2-phenyl-heptanenitrile CAS Name: 7-(2-acetyl-5-phenylmethoxyphenoxy)-2-phenylheptanenitrile IUPAC Name: 7-(2-acetyl-5-phenylmethoxyphenoxy)-2-phenylheptanenitrile Traditional Name: 7-(2-acetyl-5-benzoxy-phenoxy)-2-phenyl-enanthonitrile Formula: C28H29NO3 MolecularWeight: 427.53476

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=C(C=C(C=C1)OCC2=CC=CC=C2)OCCCCCC(C#N)C3=CC=CC=C3

Isomeric SMILES

CC(=O)C1=C(C=C(C=C1)OCC2=CC=CC=C2)OCCCCCC(C#N)C3=CC=CC=C3

InChI

InChI=1S/C28H29NO3/c1-22(30)27-17-16-26(32-21-23-11-5-2-6-12-23)19-28(27)31-18-10-4-9-15-25(20-29)24-13-7-3-8-14-24/h2-3,5-8,11-14,16-17,19,25H,4,9-10,15,18,21H2,1H3