1-[4-[3-[4-[bis(3-fluorophenyl)methyl]piperidin-1-yl]propoxy]-3-methoxy-phenyl]ethanone; 2-oxidanyl-2-phenyl-ethanoic acid

Systemtic Name: 1-[4-[3-[4-[bis(3-fluorophenyl)methyl]piperidin-1-yl]propoxy]-3-methoxy-phenyl]ethanone; 2-oxidanyl-2-phenyl-ethanoic acid Openeye Name: 1-[4-[3-[4-[bis(3-fluorophenyl)methyl]-1-piperidyl]propoxy]-3-methoxy-phenyl]ethanone; 2-hydroxy-2-phenyl-acetic acid CAS Name: 1-[4-[3-[4-[bis(3-fluorophenyl)methyl]-1-piperidinyl]propoxy]-3-methoxyphenyl]ethanone; 2-hydroxy-2-phenylacetic acid IUPAC Name: 1-[4-[3-[4-[bis(3-fluorophenyl)methyl]piperidin-1-yl]propoxy]-3-methoxyphenyl]ethanone; 2-hydroxy-2-phenylacetic acid Traditional Name: 1-[4-[3-[4-[bis(3-fluorophenyl)methyl]piperidino]propoxy]-3-methoxy-phenyl]ethanone; madelic acid Formula: C38H41F2NO6 MolecularWeight: 645.732046

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC(=C(C=C1)OCCCN2CCC(CC2)C(C3=CC(=CC=C3)F)C4=CC(=CC=C4)F)OC.C1=CC=C(C=C1)C(C(=O)O)O

Isomeric SMILES

CC(=O)C1=CC(=C(C=C1)OCCCN2CCC(CC2)C(C3=CC(=CC=C3)F)C4=CC(=CC=C4)F)OC.C1=CC=C(C=C1)C(C(=O)O)O

InChI

InChI=1S/C30H33F2NO3.C8H8O3/c1-21(34)23-10-11-28(29(20-23)35-2)36-17-5-14-33-15-12-22(13-16-33)30(24-6-3-8-26(31)18-24)25-7-4-9-27(32)19-25;9-7(8(10)11)6-4-2-1-3-5-6/h3-4,6-11,18-20,22,30H,5,12-17H2,1-2H3;1-5,7,9H,(H,10,11)