2-(3-acetyloxy-5-methyl-4-nitro-phenyl)ethanoic acid

Systemtic Name: 2-(3-acetyloxy-5-methyl-4-nitro-phenyl)ethanoic acid Openeye Name: 2-(3-acetoxy-5-methyl-4-nitro-phenyl)acetic acid CAS Name: 2-(3-acetyloxy-5-methyl-4-nitrophenyl)acetic acid IUPAC Name: 2-(3-acetyloxy-5-methyl-4-nitrophenyl)acetic acid Traditional Name: 2-(3-acetoxy-5-methyl-4-nitro-phenyl)acetic acid Formula: C11H11NO6 MolecularWeight: 253.20814

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC(=C1)CC(=O)O)OC(=O)C)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C(=CC(=C1)CC(=O)O)OC(=O)C)[N+](=O)[O-]

InChI

InChI=1S/C11H11NO6/c1-6-3-8(5-10(14)15)4-9(18-7(2)13)11(6)12(16)17/h3-4H,5H2,1-2H3,(H,14,15)