2-[4-(1,3-dioxolan-2-yl)-2-nitro-phenoxy]pentanoic acid

Systemtic Name: 2-[4-(1,3-dioxolan-2-yl)-2-nitro-phenoxy]pentanoic acid Openeye Name: 2-[4-(1,3-dioxolan-2-yl)-2-nitro-phenoxy]pentanoic acid CAS Name: 2-[4-(1,3-dioxolan-2-yl)-2-nitrophenoxy]pentanoic acid IUPAC Name: 2-[4-(1,3-dioxolan-2-yl)-2-nitrophenoxy]pentanoic acid Traditional Name: 2-[4-(1,3-dioxolan-2-yl)-2-nitro-phenoxy]valeric acid Formula: C14H17NO7 MolecularWeight: 311.28728

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCC(C(=O)O)OC1=C(C=C(C=C1)C2OCCO2)[N+](=O)[O-]

Isomeric SMILES

CCCC(C(=O)O)OC1=C(C=C(C=C1)C2OCCO2)[N+](=O)[O-]

InChI

InChI=1S/C14H17NO7/c1-2-3-12(13(16)17)22-11-5-4-9(8-10(11)15(18)19)14-20-6-7-21-14/h4-5,8,12,14H,2-3,6-7H2,1H3,(H,16,17)