2-[4-[(3-nitrophenyl)methyl]phenoxy]oxane-3,4,5-triol

Systemtic Name: 2-[4-[(3-nitrophenyl)methyl]phenoxy]oxane-3,4,5-triol Openeye Name: 2-[4-[(3-nitrophenyl)methyl]phenoxy]tetrahydropyran-3,4,5-triol CAS Name: 2-[4-[(3-nitrophenyl)methyl]phenoxy]oxane-3,4,5-triol IUPAC Name: 2-[4-[(3-nitrophenyl)methyl]phenoxy]oxane-3,4,5-triol Traditional Name: 2-[4-(3-nitrobenzyl)phenoxy]tetrahydropyran-3,4,5-triol Formula: C18H19NO7 MolecularWeight: 361.34596

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Descriptors Computed from Structure

Canonical SMILES:

C1C(C(C(C(O1)OC2=CC=C(C=C2)CC3=CC(=CC=C3)[N+](=O)[O-])O)O)O

Isomeric SMILES

C1C(C(C(C(O1)OC2=CC=C(C=C2)CC3=CC(=CC=C3)[N+](=O)[O-])O)O)O

InChI

InChI=1S/C18H19NO7/c20-15-10-25-18(17(22)16(15)21)26-14-6-4-11(5-7-14)8-12-2-1-3-13(9-12)19(23)24/h1-7,9,15-18,20-22H,8,10H2