5-[[3-[(3-carboxy-4-oxidanyl-phenyl)carbamoyl]-5-nitro-phenyl]carbonylamino]-2-oxidanyl-benzoic acid

Systemtic Name: 5-[[3-[(3-carboxy-4-oxidanyl-phenyl)carbamoyl]-5-nitro-phenyl]carbonylamino]-2-oxidanyl-benzoic acid Openeye Name: 5-[[3-[(3-carboxy-4-hydroxy-phenyl)carbamoyl]-5-nitro-benzoyl]amino]-2-hydroxy-benzoic acid CAS Name: 5-[[[3-[(3-carboxy-4-hydroxyanilino)-oxomethyl]-5-nitrophenyl]-oxomethyl]amino]-2-hydroxybenzoic acid IUPAC Name: 5-[[3-[(3-carboxy-4-hydroxyphenyl)carbamoyl]-5-nitrobenzoyl]amino]-2-hydroxybenzoic acid Traditional Name: 5-[[3-[(3-carboxy-4-hydroxy-phenyl)carbamoyl]-5-nitro-benzoyl]amino]-2-hydroxy-benzoic acid Formula: C22H15N3O10 MolecularWeight: 481.3686

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1NC(=O)C2=CC(=CC(=C2)[N+](=O)[O-])C(=O)NC3=CC(=C(C=C3)O)C(=O)O)C(=O)O)O

Isomeric SMILES

C1=CC(=C(C=C1NC(=O)C2=CC(=CC(=C2)[N+](=O)[O-])C(=O)NC3=CC(=C(C=C3)O)C(=O)O)C(=O)O)O

InChI

InChI=1S/C22H15N3O10/c26-17-3-1-12(8-15(17)21(30)31)23-19(28)10-5-11(7-14(6-10)25(34)35)20(29)24-13-2-4-18(27)16(9-13)22(32)33/h1-9,26-27H,(H,23,28)(H,24,29)(H,30,31)(H,32,33)