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

Systemtic Name: 2-[[1-cyclohexyl-5-(2-methylpropylcarbamoyl)-2,6-bis(oxidanyl)-4-oxidanylidene-pyridin-3-yl]carbonylamino]ethanoic acid Openeye Name: 2-[[1-cyclohexyl-2,6-dihydroxy-5-(isobutylcarbamoyl)-4-oxo-pyridine-3-carbonyl]amino]acetic acid CAS Name: 2-[[[1-cyclohexyl-2,6-dihydroxy-5-[(2-methylpropylamino)-oxomethyl]-4-oxo-3-pyridinyl]-oxomethyl]amino]acetic acid IUPAC Name: 2-[[1-cyclohexyl-2,6-dihydroxy-5-(2-methylpropylcarbamoyl)-4-oxopyridine-3-carbonyl]amino]acetic acid Traditional Name: 2-[[1-cyclohexyl-2,6-dihydroxy-5-(isobutylcarbamoyl)-4-keto-nicotinoyl]amino]acetic acid Formula: C19H27N3O7 MolecularWeight: 409.43358

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CNC(=O)C1=C(N(C(=C(C1=O)C(=O)NCC(=O)O)O)C2CCCCC2)O

Isomeric SMILES

CC(C)CNC(=O)C1=C(N(C(=C(C1=O)C(=O)NCC(=O)O)O)C2CCCCC2)O

InChI

InChI=1S/C19H27N3O7/c1-10(2)8-20-16(26)13-15(25)14(17(27)21-9-12(23)24)19(29)22(18(13)28)11-6-4-3-5-7-11/h10-11,28-29H,3-9H2,1-2H3,(H,20,26)(H,21,27)(H,23,24)