2-[[1-cyclohexyl-5-(2-cyclopropylethylcarbamoyl)-2,6-bis(oxidanyl)-4-oxidanylidene-pyridin-3-yl]carbonylamino]ethanoic acid

Systemtic Name: 2-[[1-cyclohexyl-5-(2-cyclopropylethylcarbamoyl)-2,6-bis(oxidanyl)-4-oxidanylidene-pyridin-3-yl]carbonylamino]ethanoic acid Openeye Name: 2-[[1-cyclohexyl-5-(2-cyclopropylethylcarbamoyl)-2,6-dihydroxy-4-oxo-pyridine-3-carbonyl]amino]acetic acid CAS Name: 2-[[[1-cyclohexyl-5-[(2-cyclopropylethylamino)-oxomethyl]-2,6-dihydroxy-4-oxo-3-pyridinyl]-oxomethyl]amino]acetic acid IUPAC Name: 2-[[1-cyclohexyl-5-(2-cyclopropylethylcarbamoyl)-2,6-dihydroxy-4-oxopyridine-3-carbonyl]amino]acetic acid Traditional Name: 2-[[1-cyclohexyl-5-(2-cyclopropylethylcarbamoyl)-2,6-dihydroxy-4-keto-nicotinoyl]amino]acetic acid Formula: C20H27N3O7 MolecularWeight: 421.44428

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)N2C(=C(C(=O)C(=C2O)C(=O)NCC(=O)O)C(=O)NCCC3CC3)O

Isomeric SMILES

C1CCC(CC1)N2C(=C(C(=O)C(=C2O)C(=O)NCC(=O)O)C(=O)NCCC3CC3)O

InChI

InChI=1S/C20H27N3O7/c24-13(25)10-22-18(28)15-16(26)14(17(27)21-9-8-11-6-7-11)19(29)23(20(15)30)12-4-2-1-3-5-12/h11-12,29-30H,1-10H2,(H,21,27)(H,22,28)(H,24,25)