methyl 4-[4-(1-octanoylpiperidin-2-yl)oxyphenyl]benzoate

Systemtic Name: methyl 4-[4-(1-octanoylpiperidin-2-yl)oxyphenyl]benzoate Openeye Name: methyl 4-[4-[(1-octanoyl-2-piperidyl)oxy]phenyl]benzoate CAS Name: 4-[4-[[1-(1-oxooctyl)-2-piperidinyl]oxy]phenyl]benzoic acid methyl ester IUPAC Name: methyl 4-[4-(1-octanoylpiperidin-2-yl)oxyphenyl]benzoate Traditional Name: 4-[4-[(1-caprylyl-2-piperidyl)oxy]phenyl]benzoic acid methyl ester Formula: C27H35NO4 MolecularWeight: 437.5711

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC(=O)N1CCCCC1OC2=CC=C(C=C2)C3=CC=C(C=C3)C(=O)OC

Isomeric SMILES

CCCCCCCC(=O)N1CCCCC1OC2=CC=C(C=C2)C3=CC=C(C=C3)C(=O)OC

InChI

InChI=1S/C27H35NO4/c1-3-4-5-6-7-10-25(29)28-20-9-8-11-26(28)32-24-18-16-22(17-19-24)21-12-14-23(15-13-21)27(30)31-2/h12-19,26H,3-11,20H2,1-2H3