2-(3-fluoranyl-3-methyl-butyl)-4-oxidanyl-6-phenyl-5-(quinoxalin-2-ylcarbonylamino)hexanoic acid

Systemtic Name: 2-(3-fluoranyl-3-methyl-butyl)-4-oxidanyl-6-phenyl-5-(quinoxalin-2-ylcarbonylamino)hexanoic acid Openeye Name: 2-(3-fluoro-3-methyl-butyl)-4-hydroxy-6-phenyl-5-(quinoxaline-2-carbonylamino)hexanoic acid CAS Name: 2-(3-fluoro-3-methylbutyl)-4-hydroxy-5-[[oxo(2-quinoxalinyl)methyl]amino]-6-phenylhexanoic acid IUPAC Name: 2-(3-fluoro-3-methylbutyl)-4-hydroxy-6-phenyl-5-(quinoxaline-2-carbonylamino)hexanoic acid Traditional Name: 2-(3-fluoro-3-methyl-butyl)-4-hydroxy-6-phenyl-5-(quinoxaline-2-carbonylamino)hexanoic acid Formula: C26H30FN3O4 MolecularWeight: 467.532503

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(CCC(CC(C(CC1=CC=CC=C1)NC(=O)C2=NC3=CC=CC=C3N=C2)O)C(=O)O)F

Isomeric SMILES

CC(C)(CCC(CC(C(CC1=CC=CC=C1)NC(=O)C2=NC3=CC=CC=C3N=C2)O)C(=O)O)F

InChI

InChI=1S/C26H30FN3O4/c1-26(2,27)13-12-18(25(33)34)15-23(31)21(14-17-8-4-3-5-9-17)30-24(32)22-16-28-19-10-6-7-11-20(19)29-22/h3-11,16,18,21,23,31H,12-15H2,1-2H3,(H,30,32)(H,33,34)