3-[[4-[(5-aminocarbonyl-4-oxidanyl-imidazol-1-yl)methyl]phenyl]carbamoylamino]benzoic acid

Systemtic Name: 3-[[4-[(5-aminocarbonyl-4-oxidanyl-imidazol-1-yl)methyl]phenyl]carbamoylamino]benzoic acid Openeye Name: 3-[[4-[(5-carbamoyl-4-hydroxy-imidazol-1-yl)methyl]phenyl]carbamoylamino]benzoic acid CAS Name: 3-[[[4-[(5-carbamoyl-4-hydroxy-1-imidazolyl)methyl]anilino]-oxomethyl]amino]benzoic acid IUPAC Name: 3-[[4-[(5-carbamoyl-4-hydroxyimidazol-1-yl)methyl]phenyl]carbamoylamino]benzoic acid Traditional Name: 3-[[4-[(5-carbamoyl-4-hydroxy-imidazol-1-yl)methyl]phenyl]carbamoylamino]benzoic acid Formula: C19H17N5O5 MolecularWeight: 395.36878

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)NC(=O)NC2=CC=C(C=C2)CN3C=NC(=C3C(=O)N)O)C(=O)O

Isomeric SMILES

C1=CC(=CC(=C1)NC(=O)NC2=CC=C(C=C2)CN3C=NC(=C3C(=O)N)O)C(=O)O

InChI

InChI=1S/C19H17N5O5/c20-16(25)15-17(26)21-10-24(15)9-11-4-6-13(7-5-11)22-19(29)23-14-3-1-2-12(8-14)18(27)28/h1-8,10,26H,9H2,(H2,20,25)(H,27,28)(H2,22,23,29)