[4-[2-[4-(phenylmethyl)piperidin-1-yl]propanoyl]phenyl] hexadecanoate

Systemtic Name: [4-[2-[4-(phenylmethyl)piperidin-1-yl]propanoyl]phenyl] hexadecanoate Openeye Name: [4-[2-(4-benzyl-1-piperidyl)propanoyl]phenyl] hexadecanoate CAS Name: hexadecanoic acid [4-[1-oxo-2-[4-(phenylmethyl)-1-piperidinyl]propyl]phenyl] ester IUPAC Name: [4-[2-(4-benzylpiperidin-1-yl)propanoyl]phenyl] hexadecanoate Traditional Name: palmitic acid [4-[2-(4-benzylpiperidino)propanoyl]phenyl] ester Formula: C37H55NO3 MolecularWeight: 561.8375

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCC(=O)OC1=CC=C(C=C1)C(=O)C(C)N2CCC(CC2)CC3=CC=CC=C3

Isomeric SMILES

CCCCCCCCCCCCCCCC(=O)OC1=CC=C(C=C1)C(=O)C(C)N2CCC(CC2)CC3=CC=CC=C3

InChI

InChI=1S/C37H55NO3/c1-3-4-5-6-7-8-9-10-11-12-13-14-18-21-36(39)41-35-24-22-34(23-25-35)37(40)31(2)38-28-26-33(27-29-38)30-32-19-16-15-17-20-32/h15-17,19-20,22-25,31,33H,3-14,18,21,26-30H2,1-2H3