N-[(2S,3S,5S)-2-[(4-fluoranyl-2-oxidanyl-phenyl)carbonylamino]-8-methyl-3-oxidanyl-1-phenyl-nonan-5-yl]oxane-4-carboxamide

Systemtic Name: N-[(2S,3S,5S)-2-[(4-fluoranyl-2-oxidanyl-phenyl)carbonylamino]-8-methyl-3-oxidanyl-1-phenyl-nonan-5-yl]oxane-4-carboxamide Openeye Name: N-[(1S,3S,4S)-4-[(4-fluoro-2-hydroxy-benzoyl)amino]-3-hydroxy-1-isopentyl-5-phenyl-pentyl]tetrahydropyran-4-carboxamide CAS Name: N-[(2S,3S,5S)-2-[[(4-fluoro-2-hydroxyphenyl)-oxomethyl]amino]-3-hydroxy-8-methyl-1-phenylnonan-5-yl]-4-oxanecarboxamide IUPAC Name: N-[(2S,3S,5S)-2-[(4-fluoro-2-hydroxybenzoyl)amino]-3-hydroxy-8-methyl-1-phenylnonan-5-yl]oxane-4-carboxamide Traditional Name: N-[(1S,3S,4S)-4-[(4-fluoro-2-hydroxy-benzoyl)amino]-3-hydroxy-1-isoamyl-5-phenyl-pentyl]tetrahydropyran-4-carboxamide Formula: C29H39FN2O5 MolecularWeight: 514.628763

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCC(CC(C(CC1=CC=CC=C1)NC(=O)C2=C(C=C(C=C2)F)O)O)NC(=O)C3CCOCC3

Isomeric SMILES

CC(C)CC[C@@H](C[C@@H]([C@H](CC1=CC=CC=C1)NC(=O)C2=C(C=C(C=C2)F)O)O)NC(=O)C3CCOCC3

InChI

InChI=1S/C29H39FN2O5/c1-19(2)8-10-23(31-28(35)21-12-14-37-15-13-21)18-27(34)25(16-20-6-4-3-5-7-20)32-29(36)24-11-9-22(30)17-26(24)33/h3-7,9,11,17,19,21,23,25,27,33-34H,8,10,12-16,18H2,1-2H3,(H,31,35)(H,32,36)/t23-,25-,27-/m0/s1