4-oxidanyl-3-[[1-(1-oxidanyl-1-oxidanylidene-octan-2-yl)imidazol-4-yl]carbamoyl]benzoic acid

Systemtic Name: 4-oxidanyl-3-[[1-(1-oxidanyl-1-oxidanylidene-octan-2-yl)imidazol-4-yl]carbamoyl]benzoic acid Openeye Name: 3-[[1-(1-carboxyheptyl)imidazol-4-yl]carbamoyl]-4-hydroxy-benzoic acid CAS Name: 4-hydroxy-3-[[[1-(1-hydroxy-1-oxooctan-2-yl)-4-imidazolyl]amino]-oxomethyl]benzoic acid IUPAC Name: 4-hydroxy-3-[[1-(1-hydroxy-1-oxooctan-2-yl)imidazol-4-yl]carbamoyl]benzoic acid Traditional Name: 3-[[1-(1-carboxyheptyl)imidazol-4-yl]carbamoyl]-4-hydroxy-benzoic acid Formula: C19H23N3O6 MolecularWeight: 389.40242

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC(C(=O)O)N1C=C(N=C1)NC(=O)C2=C(C=CC(=C2)C(=O)O)O

Isomeric SMILES

CCCCCCC(C(=O)O)N1C=C(N=C1)NC(=O)C2=C(C=CC(=C2)C(=O)O)O

InChI

InChI=1S/C19H23N3O6/c1-2-3-4-5-6-14(19(27)28)22-10-16(20-11-22)21-17(24)13-9-12(18(25)26)7-8-15(13)23/h7-11,14,23H,2-6H2,1H3,(H,21,24)(H,25,26)(H,27,28)