2-[4-[2-(2,4-dinitrophenoxy)ethanoylamino]-3-methyl-phenoxy]ethanoic acid

Systemtic Name: 2-[4-[2-(2,4-dinitrophenoxy)ethanoylamino]-3-methyl-phenoxy]ethanoic acid Openeye Name: 2-[4-[[2-(2,4-dinitrophenoxy)acetyl]amino]-3-methyl-phenoxy]acetic acid CAS Name: 2-[4-[[2-(2,4-dinitrophenoxy)-1-oxoethyl]amino]-3-methylphenoxy]acetic acid IUPAC Name: 2-[4-[[2-(2,4-dinitrophenoxy)acetyl]amino]-3-methylphenoxy]acetic acid Traditional Name: 2-[4-[[2-(2,4-dinitrophenoxy)acetyl]amino]-3-methyl-phenoxy]acetic acid Formula: C17H15N3O9 MolecularWeight: 405.3157

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)OCC(=O)O)NC(=O)COC2=C(C=C(C=C2)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=CC(=C1)OCC(=O)O)NC(=O)COC2=C(C=C(C=C2)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C17H15N3O9/c1-10-6-12(28-9-17(22)23)3-4-13(10)18-16(21)8-29-15-5-2-11(19(24)25)7-14(15)20(26)27/h2-7H,8-9H2,1H3,(H,18,21)(H,22,23)