methyl 8-phenylmethoxy-4-(3-pyridin-3-ylpropyl)octanoate

Systemtic Name: methyl 8-phenylmethoxy-4-(3-pyridin-3-ylpropyl)octanoate Openeye Name: methyl 8-benzyloxy-4-[3-(3-pyridyl)propyl]octanoate CAS Name: 8-phenylmethoxy-4-[3-(3-pyridinyl)propyl]octanoic acid methyl ester IUPAC Name: methyl 8-phenylmethoxy-4-(3-pyridin-3-ylpropyl)octanoate Traditional Name: 8-benzoxy-4-[3-(3-pyridyl)propyl]caprylic acid methyl ester Formula: C24H33NO3 MolecularWeight: 383.52372

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCC(CCCCOCC1=CC=CC=C1)CCCC2=CN=CC=C2

Isomeric SMILES

COC(=O)CCC(CCCCOCC1=CC=CC=C1)CCCC2=CN=CC=C2

InChI

InChI=1S/C24H33NO3/c1-27-24(26)16-15-21(12-7-13-22-14-8-17-25-19-22)9-5-6-18-28-20-23-10-3-2-4-11-23/h2-4,8,10-11,14,17,19,21H,5-7,9,12-13,15-16,18,20H2,1H3