4-azanyl-2-(1-azanyl-3-fluoranyl-2-oxidanylidene-propyl)-2-(3-chloranyl-5-fluoranyl-1-methyl-indol-2-yl)carbonyl-5-methyl-3-oxidanylidene-hexanoic acid

Systemtic Name: 4-azanyl-2-(1-azanyl-3-fluoranyl-2-oxidanylidene-propyl)-2-(3-chloranyl-5-fluoranyl-1-methyl-indol-2-yl)carbonyl-5-methyl-3-oxidanylidene-hexanoic acid Openeye Name: 4-amino-2-(1-amino-3-fluoro-2-oxo-propyl)-2-(3-chloro-5-fluoro-1-methyl-indole-2-carbonyl)-5-methyl-3-oxo-hexanoic acid CAS Name: 4-amino-2-(1-amino-3-fluoro-2-oxopropyl)-2-[(3-chloro-5-fluoro-1-methyl-2-indolyl)-oxomethyl]-5-methyl-3-oxohexanoic acid IUPAC Name: 4-amino-2-(1-amino-3-fluoro-2-oxopropyl)-2-(3-chloro-5-fluoro-1-methylindole-2-carbonyl)-5-methyl-3-oxohexanoic acid Traditional Name: 4-amino-2-(1-amino-3-fluoro-2-keto-propyl)-2-(3-chloro-5-fluoro-1-methyl-indole-2-carbonyl)-3-keto-5-methyl-hexanoic acid Formula: C20H22ClF2N3O5 MolecularWeight: 457.855586

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)C(C(C(=O)CF)N)(C(=O)C1=C(C2=C(N1C)C=CC(=C2)F)Cl)C(=O)O)N

Isomeric SMILES

CC(C)C(C(=O)C(C(C(=O)CF)N)(C(=O)C1=C(C2=C(N1C)C=CC(=C2)F)Cl)C(=O)O)N

InChI

InChI=1S/C20H22ClF2N3O5/c1-8(2)14(24)17(28)20(19(30)31,16(25)12(27)7-22)18(29)15-13(21)10-6-9(23)4-5-11(10)26(15)3/h4-6,8,14,16H,7,24-25H2,1-3H3,(H,30,31)