2-[2,3-dimethyl-5-(1-oxidanylbutyl)-4-[oxidanyl(diphenyl)methyl]-6-piperidin-1-yl-phenyl]ethanoate

Systemtic Name: 2-[2,3-dimethyl-5-(1-oxidanylbutyl)-4-[oxidanyl(diphenyl)methyl]-6-piperidin-1-yl-phenyl]ethanoate Openeye Name: 2-[5-(1-hydroxybutyl)-4-[hydroxy(diphenyl)methyl]-2,3-dimethyl-6-(1-piperidyl)phenyl]acetate CAS Name: 2-[5-(1-hydroxybutyl)-4-[hydroxy(diphenyl)methyl]-2,3-dimethyl-6-(1-piperidinyl)phenyl]acetate IUPAC Name: 2-[5-(1-hydroxybutyl)-4-[hydroxy(diphenyl)methyl]-2,3-dimethyl-6-piperidin-1-ylphenyl]acetate Traditional Name: 2-[5-(1-hydroxybutyl)-4-[hydroxy(diphenyl)methyl]-2,3-dimethyl-6-piperidino-phenyl]acetate Formula: C32H38NO4- MolecularWeight: 500.64842

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C1=C(C(=C(C(=C1N2CCCCC2)CC(=O)[O-])C)C)C(C3=CC=CC=C3)(C4=CC=CC=C4)O)O

Isomeric SMILES

CCCC(C1=C(C(=C(C(=C1N2CCCCC2)CC(=O)[O-])C)C)C(C3=CC=CC=C3)(C4=CC=CC=C4)O)O

InChI

InChI=1S/C32H39NO4/c1-4-14-27(34)29-30(32(37,24-15-8-5-9-16-24)25-17-10-6-11-18-25)23(3)22(2)26(21-28(35)36)31(29)33-19-12-7-13-20-33/h5-6,8-11,15-18,27,34,37H,4,7,12-14,19-21H2,1-3H3,(H,35,36)/p-1