2-[2-[(5-fluoranyl-1-methyl-indol-2-yl)carbonylamino]propanoylamino]-3-methyl-pentanoic acid

Systemtic Name: 2-[2-[(5-fluoranyl-1-methyl-indol-2-yl)carbonylamino]propanoylamino]-3-methyl-pentanoic acid Openeye Name: 2-[2-[(5-fluoro-1-methyl-indole-2-carbonyl)amino]propanoylamino]-3-methyl-pentanoic acid CAS Name: 2-[[2-[[(5-fluoro-1-methyl-2-indolyl)-oxomethyl]amino]-1-oxopropyl]amino]-3-methylpentanoic acid IUPAC Name: 2-[2-[(5-fluoro-1-methylindole-2-carbonyl)amino]propanoylamino]-3-methylpentanoic acid Traditional Name: 2-[2-[(5-fluoro-1-methyl-indole-2-carbonyl)amino]propanoylamino]-3-methyl-valeric acid Formula: C19H24FN3O4 MolecularWeight: 377.409963

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C(C(=O)O)NC(=O)C(C)NC(=O)C1=CC2=C(N1C)C=CC(=C2)F

Isomeric SMILES

CCC(C)C(C(=O)O)NC(=O)C(C)NC(=O)C1=CC2=C(N1C)C=CC(=C2)F

InChI

InChI=1S/C19H24FN3O4/c1-5-10(2)16(19(26)27)22-17(24)11(3)21-18(25)15-9-12-8-13(20)6-7-14(12)23(15)4/h6-11,16H,5H2,1-4H3,(H,21,25)(H,22,24)(H,26,27)