1-[2-methyl-3-(4-nitro-2-phenyl-phenoxy)-2-oxidanyl-propyl]piperidin-3-ol

Systemtic Name: 1-[2-methyl-3-(4-nitro-2-phenyl-phenoxy)-2-oxidanyl-propyl]piperidin-3-ol Openeye Name: 1-[2-hydroxy-2-methyl-3-(4-nitro-2-phenyl-phenoxy)propyl]piperidin-3-ol CAS Name: 1-[2-hydroxy-2-methyl-3-(4-nitro-2-phenylphenoxy)propyl]-3-piperidinol IUPAC Name: 1-[2-hydroxy-2-methyl-3-(4-nitro-2-phenylphenoxy)propyl]piperidin-3-ol Traditional Name: 1-[2-hydroxy-2-methyl-3-(4-nitro-2-phenyl-phenoxy)propyl]piperidin-3-ol Formula: C21H26N2O5 MolecularWeight: 386.44154

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Descriptors Computed from Structure

Canonical SMILES:

CC(CN1CCCC(C1)O)(COC2=C(C=C(C=C2)[N+](=O)[O-])C3=CC=CC=C3)O

Isomeric SMILES

CC(CN1CCCC(C1)O)(COC2=C(C=C(C=C2)[N+](=O)[O-])C3=CC=CC=C3)O

InChI

InChI=1S/C21H26N2O5/c1-21(25,14-22-11-5-8-18(24)13-22)15-28-20-10-9-17(23(26)27)12-19(20)16-6-3-2-4-7-16/h2-4,6-7,9-10,12,18,24-25H,5,8,11,13-15H2,1H3