1-[9-azanyl-8-fluoranyl-8-methyl-5-(1,3-oxazol-2-yl)-3-oxidanyl-9-oxidanylidene-1-phenyl-nonan-2-yl]-4H-quinoxaline-2-carboxylic acid

Systemtic Name: 1-[9-azanyl-8-fluoranyl-8-methyl-5-(1,3-oxazol-2-yl)-3-oxidanyl-9-oxidanylidene-1-phenyl-nonan-2-yl]-4H-quinoxaline-2-carboxylic acid Openeye Name: 1-(8-amino-1-benzyl-7-fluoro-2-hydroxy-7-methyl-4-oxazol-2-yl-8-oxo-octyl)-4H-quinoxaline-2-carboxylic acid CAS Name: 1-[9-amino-8-fluoro-3-hydroxy-8-methyl-5-(2-oxazolyl)-9-oxo-1-phenylnonan-2-yl]-4H-quinoxaline-2-carboxylic acid IUPAC Name: 1-[9-amino-8-fluoro-3-hydroxy-8-methyl-5-(1,3-oxazol-2-yl)-9-oxo-1-phenylnonan-2-yl]-4H-quinoxaline-2-carboxylic acid Traditional Name: 1-(8-amino-1-benzyl-7-fluoro-2-hydroxy-8-keto-7-methyl-4-oxazol-2-yl-octyl)-4H-quinoxaline-2-carboxylic acid Formula: C28H31FN4O5 MolecularWeight: 522.567943

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Descriptors Computed from Structure

Canonical SMILES:

CC(CCC(CC(C(CC1=CC=CC=C1)N2C3=CC=CC=C3NC=C2C(=O)O)O)C4=NC=CO4)(C(=O)N)F

Isomeric SMILES

CC(CCC(CC(C(CC1=CC=CC=C1)N2C3=CC=CC=C3NC=C2C(=O)O)O)C4=NC=CO4)(C(=O)N)F

InChI

InChI=1S/C28H31FN4O5/c1-28(29,27(30)37)12-11-19(25-31-13-14-38-25)16-24(34)22(15-18-7-3-2-4-8-18)33-21-10-6-5-9-20(21)32-17-23(33)26(35)36/h2-10,13-14,17,19,22,24,32,34H,11-12,15-16H2,1H3,(H2,30,37)(H,35,36)