[6-(4-nitrophenoxy)-4-oxidanyl-5-phenylmethoxy-2-(phenylmethoxymethyl)oxan-3-yl] ethanoate

Systemtic Name: [6-(4-nitrophenoxy)-4-oxidanyl-5-phenylmethoxy-2-(phenylmethoxymethyl)oxan-3-yl] ethanoate Openeye Name: [5-benzyloxy-2-(benzyloxymethyl)-4-hydroxy-6-(4-nitrophenoxy)tetrahydropyran-3-yl] acetate CAS Name: acetic acid [4-hydroxy-6-(4-nitrophenoxy)-5-phenylmethoxy-2-(phenylmethoxymethyl)-3-oxanyl] ester IUPAC Name: [4-hydroxy-6-(4-nitrophenoxy)-5-phenylmethoxy-2-(phenylmethoxymethyl)oxan-3-yl] acetate Traditional Name: acetic acid [5-benzoxy-2-(benzoxymethyl)-4-hydroxy-6-(4-nitrophenoxy)tetrahydropyran-3-yl] ester Formula: C28H29NO9 MolecularWeight: 523.53116

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC1C(OC(C(C1O)OCC2=CC=CC=C2)OC3=CC=C(C=C3)[N+](=O)[O-])COCC4=CC=CC=C4

Isomeric SMILES

CC(=O)OC1C(OC(C(C1O)OCC2=CC=CC=C2)OC3=CC=C(C=C3)[N+](=O)[O-])COCC4=CC=CC=C4

InChI

InChI=1S/C28H29NO9/c1-19(30)36-26-24(18-34-16-20-8-4-2-5-9-20)38-28(37-23-14-12-22(13-15-23)29(32)33)27(25(26)31)35-17-21-10-6-3-7-11-21/h2-15,24-28,31H,16-18H2,1H3