4-azanyl-2-(1-azanyl-3-fluoranyl-2-oxidanylidene-propyl)-2-(3-chloranyl-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-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-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-1-methyl-2-indolyl)-oxomethyl]-5-methyl-3-oxohexanoic acid IUPAC Name: 4-amino-2-(1-amino-3-fluoro-2-oxopropyl)-2-(3-chloro-1-methylindole-2-carbonyl)-5-methyl-3-oxohexanoic acid Traditional Name: 4-amino-2-(1-amino-3-fluoro-2-keto-propyl)-2-(3-chloro-1-methyl-indole-2-carbonyl)-3-keto-5-methyl-hexanoic acid Formula: C20H23ClFN3O5 MolecularWeight: 439.865123

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)C(C(C(=O)CF)N)(C(=O)C1=C(C2=CC=CC=C2N1C)Cl)C(=O)O)N

Isomeric SMILES

CC(C)C(C(=O)C(C(C(=O)CF)N)(C(=O)C1=C(C2=CC=CC=C2N1C)Cl)C(=O)O)N

InChI

InChI=1S/C20H23ClFN3O5/c1-9(2)14(23)17(27)20(19(29)30,16(24)12(26)8-22)18(28)15-13(21)10-6-4-5-7-11(10)25(15)3/h4-7,9,14,16H,8,23-24H2,1-3H3,(H,29,30)