2-[[5-[carboxymethyl(methoxycarbonyl)amino]cyclooctyl]-methoxycarbonyl-amino]ethanoic acid

Systemtic Name: 2-[[5-[carboxymethyl(methoxycarbonyl)amino]cyclooctyl]-methoxycarbonyl-amino]ethanoic acid Openeye Name: 2-[[5-[carboxymethyl(methoxycarbonyl)amino]cyclooctyl]-methoxycarbonyl-amino]acetic acid CAS Name: 2-[[5-[carboxymethyl(methoxycarbonyl)amino]cyclooctyl]-methoxycarbonylamino]acetic acid IUPAC Name: 2-[[5-[carboxymethyl(methoxycarbonyl)amino]cyclooctyl]-methoxycarbonylamino]acetic acid Traditional Name: 2-[carbomethoxy-[5-[carbomethoxy(carboxymethyl)amino]cyclooctyl]amino]acetic acid Formula: C16H26N2O8 MolecularWeight: 374.38624

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)N(CC(=O)O)C1CCCC(CCC1)N(CC(=O)O)C(=O)OC

Isomeric SMILES

COC(=O)N(CC(=O)O)C1CCCC(CCC1)N(CC(=O)O)C(=O)OC

InChI

InChI=1S/C16H26N2O8/c1-25-15(23)17(9-13(19)20)11-5-3-7-12(8-4-6-11)18(10-14(21)22)16(24)26-2/h11-12H,3-10H2,1-2H3,(H,19,20)(H,21,22)