2-[3-[2-[[4-(acetamidomethyl)cyclohexyl]carbonylamino]ethanoyl]-2-(carboxymethyloxy)phenoxy]ethanoic acid

Systemtic Name: 2-[3-[2-[[4-(acetamidomethyl)cyclohexyl]carbonylamino]ethanoyl]-2-(carboxymethyloxy)phenoxy]ethanoic acid Openeye Name: 2-[3-[2-[[4-(acetamidomethyl)cyclohexanecarbonyl]amino]acetyl]-2-(carboxymethyloxy)phenoxy]acetic acid CAS Name: 2-[3-[2-[[[4-(acetamidomethyl)cyclohexyl]-oxomethyl]amino]-1-oxoethyl]-2-(carboxymethyloxy)phenoxy]acetic acid IUPAC Name: 2-[3-[2-[[4-(acetamidomethyl)cyclohexanecarbonyl]amino]acetyl]-2-(carboxymethyloxy)phenoxy]acetic acid Traditional Name: 2-[3-[2-[[4-(acetamidomethyl)cyclohexanecarbonyl]amino]acetyl]-2-(carboxymethyloxy)phenoxy]acetic acid Formula: C22H28N2O9 MolecularWeight: 464.46572

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NCC1CCC(CC1)C(=O)NCC(=O)C2=C(C(=CC=C2)OCC(=O)O)OCC(=O)O

Isomeric SMILES

CC(=O)NCC1CCC(CC1)C(=O)NCC(=O)C2=C(C(=CC=C2)OCC(=O)O)OCC(=O)O

InChI

InChI=1S/C22H28N2O9/c1-13(25)23-9-14-5-7-15(8-6-14)22(31)24-10-17(26)16-3-2-4-18(32-11-19(27)28)21(16)33-12-20(29)30/h2-4,14-15H,5-12H2,1H3,(H,23,25)(H,24,31)(H,27,28)(H,29,30)