1-[1-[3-(3-nitrophenoxy)-2-oxidanyl-propyl]-4-phenyl-piperidin-4-yl]ethanone

Systemtic Name: 1-[1-[3-(3-nitrophenoxy)-2-oxidanyl-propyl]-4-phenyl-piperidin-4-yl]ethanone Openeye Name: 1-[1-[2-hydroxy-3-(3-nitrophenoxy)propyl]-4-phenyl-4-piperidyl]ethanone CAS Name: 1-[1-[2-hydroxy-3-(3-nitrophenoxy)propyl]-4-phenyl-4-piperidinyl]ethanone IUPAC Name: 1-[1-[2-hydroxy-3-(3-nitrophenoxy)propyl]-4-phenylpiperidin-4-yl]ethanone Traditional Name: 1-[1-[2-hydroxy-3-(3-nitrophenoxy)propyl]-4-phenyl-4-piperidyl]ethanone Formula: C22H26N2O5 MolecularWeight: 398.45224

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1(CCN(CC1)CC(COC2=CC=CC(=C2)[N+](=O)[O-])O)C3=CC=CC=C3

Isomeric SMILES

CC(=O)C1(CCN(CC1)CC(COC2=CC=CC(=C2)[N+](=O)[O-])O)C3=CC=CC=C3

InChI

InChI=1S/C22H26N2O5/c1-17(25)22(18-6-3-2-4-7-18)10-12-23(13-11-22)15-20(26)16-29-21-9-5-8-19(14-21)24(27)28/h2-9,14,20,26H,10-13,15-16H2,1H3