3-[[2-[(1-but-3-enylindol-2-yl)carbonylamino]-3-methyl-butanoyl]amino]-5-fluoranyl-4-oxidanylidene-pentanoic acid

Systemtic Name: 3-[[2-[(1-but-3-enylindol-2-yl)carbonylamino]-3-methyl-butanoyl]amino]-5-fluoranyl-4-oxidanylidene-pentanoic acid Openeye Name: 3-[[2-[(1-but-3-enylindole-2-carbonyl)amino]-3-methyl-butanoyl]amino]-5-fluoro-4-oxo-pentanoic acid CAS Name: 3-[[2-[[(1-but-3-enyl-2-indolyl)-oxomethyl]amino]-3-methyl-1-oxobutyl]amino]-5-fluoro-4-oxopentanoic acid IUPAC Name: 3-[[2-[(1-but-3-enylindole-2-carbonyl)amino]-3-methylbutanoyl]amino]-5-fluoro-4-oxopentanoic acid Traditional Name: 3-[[2-[(1-but-3-enylindole-2-carbonyl)amino]-3-methyl-butanoyl]amino]-5-fluoro-4-keto-valeric acid Formula: C23H28FN3O5 MolecularWeight: 445.483923

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)NC(CC(=O)O)C(=O)CF)NC(=O)C1=CC2=CC=CC=C2N1CCC=C

Isomeric SMILES

CC(C)C(C(=O)NC(CC(=O)O)C(=O)CF)NC(=O)C1=CC2=CC=CC=C2N1CCC=C

InChI

InChI=1S/C23H28FN3O5/c1-4-5-10-27-17-9-7-6-8-15(17)11-18(27)22(31)26-21(14(2)3)23(32)25-16(12-20(29)30)19(28)13-24/h4,6-9,11,14,16,21H,1,5,10,12-13H2,2-3H3,(H,25,32)(H,26,31)(H,29,30)