2-methoxy-5-[[2-(4-nitrophenyl)ethanoylamino]methyl]benzoic acid

Systemtic Name: 2-methoxy-5-[[2-(4-nitrophenyl)ethanoylamino]methyl]benzoic acid Openeye Name: 2-methoxy-5-[[[2-(4-nitrophenyl)acetyl]amino]methyl]benzoic acid CAS Name: 2-methoxy-5-[[[2-(4-nitrophenyl)-1-oxoethyl]amino]methyl]benzoic acid IUPAC Name: 2-methoxy-5-[[[2-(4-nitrophenyl)acetyl]amino]methyl]benzoic acid Traditional Name: 2-methoxy-5-[[[2-(4-nitrophenyl)acetyl]amino]methyl]benzoic acid Formula: C17H16N2O6 MolecularWeight: 344.31874

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CNC(=O)CC2=CC=C(C=C2)[N+](=O)[O-])C(=O)O

Isomeric SMILES

COC1=C(C=C(C=C1)CNC(=O)CC2=CC=C(C=C2)[N+](=O)[O-])C(=O)O

InChI

InChI=1S/C17H16N2O6/c1-25-15-7-4-12(8-14(15)17(21)22)10-18-16(20)9-11-2-5-13(6-3-11)19(23)24/h2-8H,9-10H2,1H3,(H,18,20)(H,21,22)