2-(2-methoxy-5-nitro-4-prop-2-enyl-phenoxy)ethanoic acid

Systemtic Name: 2-(2-methoxy-5-nitro-4-prop-2-enyl-phenoxy)ethanoic acid Openeye Name: 2-(4-allyl-2-methoxy-5-nitro-phenoxy)acetic acid CAS Name: 2-(2-methoxy-5-nitro-4-prop-2-enylphenoxy)acetic acid IUPAC Name: 2-(2-methoxy-5-nitro-4-prop-2-enylphenoxy)acetic acid Traditional Name: 2-(4-allyl-2-methoxy-5-nitro-phenoxy)acetic acid Formula: C12H13NO6 MolecularWeight: 267.23472

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C(=C1)CC=C)[N+](=O)[O-])OCC(=O)O

Isomeric SMILES

COC1=C(C=C(C(=C1)CC=C)[N+](=O)[O-])OCC(=O)O

InChI

InChI=1S/C12H13NO6/c1-3-4-8-5-10(18-2)11(19-7-12(14)15)6-9(8)13(16)17/h3,5-6H,1,4,7H2,2H3,(H,14,15)