N-[2-[[(3S,4S)-1-[4-(4-methylphenyl)-4-oxidanyl-cyclohexyl]-4-oxidanyl-pyrrolidin-3-yl]amino]-2-oxidanylidene-ethyl]-3-(trifluoromethyl)benzamide

Systemtic Name: N-[2-[[(3S,4S)-1-[4-(4-methylphenyl)-4-oxidanyl-cyclohexyl]-4-oxidanyl-pyrrolidin-3-yl]amino]-2-oxidanylidene-ethyl]-3-(trifluoromethyl)benzamide Openeye Name: N-[2-[[(3S,4S)-4-hydroxy-1-[4-hydroxy-4-(p-tolyl)cyclohexyl]pyrrolidin-3-yl]amino]-2-oxo-ethyl]-3-(trifluoromethyl)benzamide CAS Name: N-[2-[[(3S,4S)-4-hydroxy-1-[4-hydroxy-4-(4-methylphenyl)cyclohexyl]-3-pyrrolidinyl]amino]-2-oxoethyl]-3-(trifluoromethyl)benzamide IUPAC Name: N-[2-[[(3S,4S)-4-hydroxy-1-[4-hydroxy-4-(4-methylphenyl)cyclohexyl]pyrrolidin-3-yl]amino]-2-oxoethyl]-3-(trifluoromethyl)benzamide Traditional Name: N-[2-[[(3S,4S)-4-hydroxy-1-[4-hydroxy-4-(p-tolyl)cyclohexyl]pyrrolidin-3-yl]amino]-2-keto-ethyl]-3-(trifluoromethyl)benzamide Formula: C27H32F3N3O4 MolecularWeight: 519.55589

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2(CCC(CC2)N3CC(C(C3)O)NC(=O)CNC(=O)C4=CC(=CC=C4)C(F)(F)F)O

Isomeric SMILES

CC1=CC=C(C=C1)C2(CCC(CC2)N3C[C@@H]([C@H](C3)O)NC(=O)CNC(=O)C4=CC(=CC=C4)C(F)(F)F)O

InChI

InChI=1S/C27H32F3N3O4/c1-17-5-7-19(8-6-17)26(37)11-9-21(10-12-26)33-15-22(23(34)16-33)32-24(35)14-31-25(36)18-3-2-4-20(13-18)27(28,29)30/h2-8,13,21-23,34,37H,9-12,14-16H2,1H3,(H,31,36)(H,32,35)/t21?,22-,23-,26?/m0/s1