2-phenylmethoxy-2-(2,3,4-trimethoxy-6-nitro-phenyl)ethanoic acid

Systemtic Name: 2-phenylmethoxy-2-(2,3,4-trimethoxy-6-nitro-phenyl)ethanoic acid Openeye Name: 2-benzyloxy-2-(2,3,4-trimethoxy-6-nitro-phenyl)acetic acid CAS Name: 2-phenylmethoxy-2-(2,3,4-trimethoxy-6-nitrophenyl)acetic acid IUPAC Name: 2-phenylmethoxy-2-(2,3,4-trimethoxy-6-nitrophenyl)acetic acid Traditional Name: 2-benzoxy-2-(2,3,4-trimethoxy-6-nitro-phenyl)acetic acid Formula: C18H19NO8 MolecularWeight: 377.34536

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=C(C(=C1)[N+](=O)[O-])C(C(=O)O)OCC2=CC=CC=C2)OC)OC

Isomeric SMILES

COC1=C(C(=C(C(=C1)[N+](=O)[O-])C(C(=O)O)OCC2=CC=CC=C2)OC)OC

InChI

InChI=1S/C18H19NO8/c1-24-13-9-12(19(22)23)14(16(26-3)15(13)25-2)17(18(20)21)27-10-11-7-5-4-6-8-11/h4-9,17H,10H2,1-3H3,(H,20,21)