1-[3-[4-[(2-ethoxyphenyl)-oxidanyl-phenyl-methyl]piperidin-1-yl]phenyl]propan-1-one

Systemtic Name: 1-[3-[4-[(2-ethoxyphenyl)-oxidanyl-phenyl-methyl]piperidin-1-yl]phenyl]propan-1-one Openeye Name: 1-[3-[4-[(2-ethoxyphenyl)-hydroxy-phenyl-methyl]-1-piperidyl]phenyl]propan-1-one CAS Name: 1-[3-[4-[(2-ethoxyphenyl)-hydroxy-phenylmethyl]-1-piperidinyl]phenyl]-1-propanone IUPAC Name: 1-[3-[4-[(2-ethoxyphenyl)-hydroxy-phenylmethyl]piperidin-1-yl]phenyl]propan-1-one Traditional Name: 1-[3-[4-(hydroxy-o-phenetyl-phenyl-methyl)piperidino]phenyl]propan-1-one Formula: C29H33NO3 MolecularWeight: 443.57722

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)C1=CC(=CC=C1)N2CCC(CC2)C(C3=CC=CC=C3)(C4=CC=CC=C4OCC)O

Isomeric SMILES

CCC(=O)C1=CC(=CC=C1)N2CCC(CC2)C(C3=CC=CC=C3)(C4=CC=CC=C4OCC)O

InChI

InChI=1S/C29H33NO3/c1-3-27(31)22-11-10-14-25(21-22)30-19-17-24(18-20-30)29(32,23-12-6-5-7-13-23)26-15-8-9-16-28(26)33-4-2/h5-16,21,24,32H,3-4,17-20H2,1-2H3