2-[[[4-[[(2-carboxy-4-nitro-phenyl)carbonylamino]methyl]phenyl]methylamino]oxymethyl]-5-nitro-benzoic acid

Systemtic Name: 2-[[[4-[[(2-carboxy-4-nitro-phenyl)carbonylamino]methyl]phenyl]methylamino]oxymethyl]-5-nitro-benzoic acid Openeye Name: 2-[[[4-[[(2-carboxy-4-nitro-benzoyl)amino]methyl]phenyl]methylamino]oxymethyl]-5-nitro-benzoic acid CAS Name: 2-[[[4-[[[(2-carboxy-4-nitrophenyl)-oxomethyl]amino]methyl]phenyl]methylamino]oxymethyl]-5-nitrobenzoic acid IUPAC Name: 2-[[[4-[[(2-carboxy-4-nitrobenzoyl)amino]methyl]phenyl]methylamino]oxymethyl]-5-nitrobenzoic acid Traditional Name: 2-[[[4-[[(2-carboxy-4-nitro-benzoyl)amino]methyl]benzyl]amino]oxymethyl]-5-nitro-benzoic acid Formula: C24H20N4O10 MolecularWeight: 524.4364

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CNC(=O)C2=C(C=C(C=C2)[N+](=O)[O-])C(=O)O)CNOCC3=C(C=C(C=C3)[N+](=O)[O-])C(=O)O

Isomeric SMILES

C1=CC(=CC=C1CNC(=O)C2=C(C=C(C=C2)[N+](=O)[O-])C(=O)O)CNOCC3=C(C=C(C=C3)[N+](=O)[O-])C(=O)O

InChI

InChI=1S/C24H20N4O10/c29-22(19-8-7-18(28(36)37)10-21(19)24(32)33)25-11-14-1-3-15(4-2-14)12-26-38-13-16-5-6-17(27(34)35)9-20(16)23(30)31/h1-10,26H,11-13H2,(H,25,29)(H,30,31)(H,32,33)