6-chloranyl-5-fluoranyl-1-[1-[(2-methylpropan-2-yl)oxycarbonylamino]propan-2-yl]indole-2-carboxylic acid

Systemtic Name: 6-chloranyl-5-fluoranyl-1-[1-[(2-methylpropan-2-yl)oxycarbonylamino]propan-2-yl]indole-2-carboxylic acid Openeye Name: 1-[2-(tert-butoxycarbonylamino)-1-methyl-ethyl]-6-chloro-5-fluoro-indole-2-carboxylic acid CAS Name: 6-chloro-5-fluoro-1-[1-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]propan-2-yl]-2-indolecarboxylic acid IUPAC Name: 6-chloro-5-fluoro-1-[1-[(2-methylpropan-2-yl)oxycarbonylamino]propan-2-yl]indole-2-carboxylic acid Traditional Name: 1-[2-(tert-butoxycarbonylamino)-1-methyl-ethyl]-6-chloro-5-fluoro-indole-2-carboxylic acid Formula: C17H20ClFN2O4 MolecularWeight: 370.803103

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(CNC(=O)OC(C)(C)C)N1C2=CC(=C(C=C2C=C1C(=O)O)F)Cl

Isomeric SMILES

CC(CNC(=O)OC(C)(C)C)N1C2=CC(=C(C=C2C=C1C(=O)O)F)Cl

InChI

InChI=1S/C17H20ClFN2O4/c1-9(8-20-16(24)25-17(2,3)4)21-13-7-11(18)12(19)5-10(13)6-14(21)15(22)23/h5-7,9H,8H2,1-4H3,(H,20,24)(H,22,23)