3-methyl-5-[2-(2-nitrophenoxy)ethanoylamino]-2-oxidanyl-benzoate

Systemtic Name: 3-methyl-5-[2-(2-nitrophenoxy)ethanoylamino]-2-oxidanyl-benzoate Openeye Name: 2-hydroxy-3-methyl-5-[[2-(2-nitrophenoxy)acetyl]amino]benzoate CAS Name: 2-hydroxy-3-methyl-5-[[2-(2-nitrophenoxy)-1-oxoethyl]amino]benzoate IUPAC Name: 2-hydroxy-3-methyl-5-[[2-(2-nitrophenoxy)acetyl]amino]benzoate Traditional Name: 2-hydroxy-3-methyl-5-[[2-(2-nitrophenoxy)acetyl]amino]benzoate Formula: C16H13N2O7- MolecularWeight: 345.28362

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H14N2O7/c1-9-6-10(7-11(15(9)20)16(21)22)17-14(19)8-25-13-5-3-2-4-12(13)18(23)24/h2-7,20H,8H2,1H3,(H,17,19)(H,21,22)/p-1