3-[1-[(1R,3S)-3-propan-2-yl-3-[[6-(trifluoromethyl)-2,4-dihydro-1,3-benzoxazin-3-yl]carbonyl]cyclopentyl]-3,6-dihydro-2H-pyridin-4-yl]benzoic acid

Systemtic Name: 3-[1-[(1R,3S)-3-propan-2-yl-3-[[6-(trifluoromethyl)-2,4-dihydro-1,3-benzoxazin-3-yl]carbonyl]cyclopentyl]-3,6-dihydro-2H-pyridin-4-yl]benzoic acid Openeye Name: 3-[1-[(1R,3S)-3-isopropyl-3-[6-(trifluoromethyl)-2,4-dihydro-1,3-benzoxazine-3-carbonyl]cyclopentyl]-3,6-dihydro-2H-pyridin-4-yl]benzoic acid CAS Name: 3-[1-[(1R,3S)-3-[oxo-[6-(trifluoromethyl)-2,4-dihydro-1,3-benzoxazin-3-yl]methyl]-3-propan-2-ylcyclopentyl]-3,6-dihydro-2H-pyridin-4-yl]benzoic acid IUPAC Name: 3-[1-[(1R,3S)-3-propan-2-yl-3-[6-(trifluoromethyl)-2,4-dihydro-1,3-benzoxazine-3-carbonyl]cyclopentyl]-3,6-dihydro-2H-pyridin-4-yl]benzoic acid Traditional Name: 3-[1-[(1R,3S)-3-isopropyl-3-[6-(trifluoromethyl)-2,4-dihydro-1,3-benzoxazine-3-carbonyl]cyclopentyl]-3,6-dihydro-2H-pyridin-4-yl]benzoic acid Formula: C30H33F3N2O4 MolecularWeight: 542.58923

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1(CCC(C1)N2CCC(=CC2)C3=CC(=CC=C3)C(=O)O)C(=O)N4CC5=C(C=CC(=C5)C(F)(F)F)OC4

Isomeric SMILES

CC(C)[C@@]1(CC[C@H](C1)N2CCC(=CC2)C3=CC(=CC=C3)C(=O)O)C(=O)N4CC5=C(C=CC(=C5)C(F)(F)F)OC4

InChI

InChI=1S/C30H33F3N2O4/c1-19(2)29(28(38)35-17-23-15-24(30(31,32)33)6-7-26(23)39-18-35)11-8-25(16-29)34-12-9-20(10-13-34)21-4-3-5-22(14-21)27(36)37/h3-7,9,14-15,19,25H,8,10-13,16-18H2,1-2H3,(H,36,37)/t25-,29+/m1/s1