(2R)-2-azanyl-3-phenyl-propan-1-ol; (2R)-7-tert-butyl-6-chloranyl-2-(trifluoromethyl)-2H-chromene-3-carboxylic acid

Systemtic Name: (2R)-2-azanyl-3-phenyl-propan-1-ol; (2R)-7-tert-butyl-6-chloranyl-2-(trifluoromethyl)-2H-chromene-3-carboxylic acid Openeye Name: (2R)-2-amino-3-phenyl-propan-1-ol; (2R)-7-tert-butyl-6-chloro-2-(trifluoromethyl)-2H-chromene-3-carboxylic acid CAS Name: (2R)-2-amino-3-phenyl-1-propanol; (2R)-7-tert-butyl-6-chloro-2-(trifluoromethyl)-2H-1-benzopyran-3-carboxylic acid IUPAC Name: (2R)-2-amino-3-phenylpropan-1-ol; (2R)-7-tert-butyl-6-chloro-2-(trifluoromethyl)-2H-chromene-3-carboxylic acid Traditional Name: (2R)-2-amino-3-phenyl-propan-1-ol; (2R)-7-tert-butyl-6-chloro-2-(trifluoromethyl)-2H-chromene-3-carboxylic acid Formula: C24H27ClF3NO4 MolecularWeight: 485.92369

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=C(C=C2C=C(C(OC2=C1)C(F)(F)F)C(=O)O)Cl.C1=CC=C(C=C1)CC(CO)N

Isomeric SMILES

CC(C)(C)C1=C(C=C2C=C([C@@H](OC2=C1)C(F)(F)F)C(=O)O)Cl.C1=CC=C(C=C1)C[C@H](CO)N

InChI

InChI=1S/C15H14ClF3O3.C9H13NO/c1-14(2,3)9-6-11-7(5-10(9)16)4-8(13(20)21)12(22-11)15(17,18)19;10-9(7-11)6-8-4-2-1-3-5-8/h4-6,12H,1-3H3,(H,20,21);1-5,9,11H,6-7,10H2/t12-;9-/m11/s1