methyl (E)-6-[(2-cyanophenyl)methyl]-8-[2-(5-phenylpentoxy)phenyl]oct-7-enoate

Systemtic Name: methyl (E)-6-[(2-cyanophenyl)methyl]-8-[2-(5-phenylpentoxy)phenyl]oct-7-enoate Openeye Name: methyl (E)-6-[(2-cyanophenyl)methyl]-8-[2-(5-phenylpentoxy)phenyl]oct-7-enoate CAS Name: (E)-6-[(2-cyanophenyl)methyl]-8-[2-(5-phenylpentoxy)phenyl]-7-octenoic acid methyl ester IUPAC Name: methyl (E)-6-[(2-cyanophenyl)methyl]-8-[2-(5-phenylpentoxy)phenyl]oct-7-enoate Traditional Name: (E)-6-(2-cyanobenzyl)-8-[2-(5-phenylpentoxy)phenyl]oct-7-enoic acid methyl ester Formula: C34H39NO3 MolecularWeight: 509.67836

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCCCC(CC1=CC=CC=C1C#N)C=CC2=CC=CC=C2OCCCCCC3=CC=CC=C3

Isomeric SMILES

COC(=O)CCCCC(CC1=CC=CC=C1C#N)/C=C/C2=CC=CC=C2OCCCCCC3=CC=CC=C3

InChI

InChI=1S/C34H39NO3/c1-37-34(36)22-12-7-17-29(26-31-19-8-9-20-32(31)27-35)23-24-30-18-10-11-21-33(30)38-25-13-3-6-16-28-14-4-2-5-15-28/h2,4-5,8-11,14-15,18-21,23-24,29H,3,6-7,12-13,16-17,22,25-26H2,1H3/b24-23+