5-fluoranyl-3-[[3-methyl-2-[(1-methylindol-2-yl)carbonylamino]butanoyl]amino]-4-oxidanyl-pentanoic acid

Systemtic Name: 5-fluoranyl-3-[[3-methyl-2-[(1-methylindol-2-yl)carbonylamino]butanoyl]amino]-4-oxidanyl-pentanoic acid Openeye Name: 5-fluoro-4-hydroxy-3-[[3-methyl-2-[(1-methylindole-2-carbonyl)amino]butanoyl]amino]pentanoic acid CAS Name: 5-fluoro-4-hydroxy-3-[[3-methyl-2-[[(1-methyl-2-indolyl)-oxomethyl]amino]-1-oxobutyl]amino]pentanoic acid IUPAC Name: 5-fluoro-4-hydroxy-3-[[3-methyl-2-[(1-methylindole-2-carbonyl)amino]butanoyl]amino]pentanoic acid Traditional Name: 5-fluoro-4-hydroxy-3-[[3-methyl-2-[(1-methylindole-2-carbonyl)amino]butanoyl]amino]valeric acid Formula: C20H26FN3O5 MolecularWeight: 407.435943

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)NC(CC(=O)O)C(CF)O)NC(=O)C1=CC2=CC=CC=C2N1C

Isomeric SMILES

CC(C)C(C(=O)NC(CC(=O)O)C(CF)O)NC(=O)C1=CC2=CC=CC=C2N1C

InChI

InChI=1S/C20H26FN3O5/c1-11(2)18(20(29)22-13(9-17(26)27)16(25)10-21)23-19(28)15-8-12-6-4-5-7-14(12)24(15)3/h4-8,11,13,16,18,25H,9-10H2,1-3H3,(H,22,29)(H,23,28)(H,26,27)