1-[2-[4-[(2-carboxy-3-oxidanyl-phenyl)carbonylamino]imidazol-1-yl]octanoyl]-4-phenoxy-pyrrolidine-2-carboxylic acid

Systemtic Name: 1-[2-[4-[(2-carboxy-3-oxidanyl-phenyl)carbonylamino]imidazol-1-yl]octanoyl]-4-phenoxy-pyrrolidine-2-carboxylic acid Openeye Name: 1-[2-[4-[(2-carboxy-3-hydroxy-benzoyl)amino]imidazol-1-yl]octanoyl]-4-phenoxy-pyrrolidine-2-carboxylic acid CAS Name: 1-[2-[4-[[(2-carboxy-3-hydroxyphenyl)-oxomethyl]amino]-1-imidazolyl]-1-oxooctyl]-4-phenoxy-2-pyrrolidinecarboxylic acid IUPAC Name: 1-[2-[4-[(2-carboxy-3-hydroxybenzoyl)amino]imidazol-1-yl]octanoyl]-4-phenoxypyrrolidine-2-carboxylic acid Traditional Name: 1-[2-[4-[(2-carboxy-3-hydroxy-benzoyl)amino]imidazol-1-yl]octanoyl]-4-phenoxy-proline Formula: C30H34N4O8 MolecularWeight: 578.61296

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC(C(=O)N1CC(CC1C(=O)O)OC2=CC=CC=C2)N3C=C(N=C3)NC(=O)C4=C(C(=CC=C4)O)C(=O)O

Isomeric SMILES

CCCCCCC(C(=O)N1CC(CC1C(=O)O)OC2=CC=CC=C2)N3C=C(N=C3)NC(=O)C4=C(C(=CC=C4)O)C(=O)O

InChI

InChI=1S/C30H34N4O8/c1-2-3-4-8-13-22(28(37)34-16-20(15-23(34)29(38)39)42-19-10-6-5-7-11-19)33-17-25(31-18-33)32-27(36)21-12-9-14-24(35)26(21)30(40)41/h5-7,9-12,14,17-18,20,22-23,35H,2-4,8,13,15-16H2,1H3,(H,32,36)(H,38,39)(H,40,41)