N-[4-(methoxymethyl)-1-(2-thiophen-2-ylethyl)piperidin-4-yl]-N-phenyl-propanamide; octadecanoic acid

Systemtic Name: N-[4-(methoxymethyl)-1-(2-thiophen-2-ylethyl)piperidin-4-yl]-N-phenyl-propanamide; octadecanoic acid Openeye Name: N-[4-(methoxymethyl)-1-[2-(2-thienyl)ethyl]-4-piperidyl]-N-phenyl-propanamide; stearic acid CAS Name: N-[4-(methoxymethyl)-1-(2-thiophen-2-ylethyl)-4-piperidinyl]-N-phenylpropanamide; octadecanoic acid IUPAC Name: N-[4-(methoxymethyl)-1-(2-thiophen-2-ylethyl)piperidin-4-yl]-N-phenylpropanamide; octadecanoic acid Traditional Name: N-[4-(methoxymethyl)-1-[2-(2-thienyl)ethyl]-4-piperidyl]-N-phenyl-propionamide; stearic acid Formula: C40H66N2O4S MolecularWeight: 671.02804

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCC(=O)O.CCC(=O)N(C1=CC=CC=C1)C2(CCN(CC2)CCC3=CC=CS3)COC

Isomeric SMILES

CCCCCCCCCCCCCCCCCC(=O)O.CCC(=O)N(C1=CC=CC=C1)C2(CCN(CC2)CCC3=CC=CS3)COC

InChI

InChI=1S/C22H30N2O2S.C18H36O2/c1-3-21(25)24(19-8-5-4-6-9-19)22(18-26-2)12-15-23(16-13-22)14-11-20-10-7-17-27-20;1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18(19)20/h4-10,17H,3,11-16,18H2,1-2H3;2-17H2,1H3,(H,19,20)