2-[3-(3-bromophenyl)propanoylamino]-2-methyl-pentanoic acid

Systemtic Name: 2-[3-(3-bromophenyl)propanoylamino]-2-methyl-pentanoic acid Openeye Name: 2-[3-(3-bromophenyl)propanoylamino]-2-methyl-pentanoic acid CAS Name: 2-[[3-(3-bromophenyl)-1-oxopropyl]amino]-2-methylpentanoic acid IUPAC Name: 2-[3-(3-bromophenyl)propanoylamino]-2-methylpentanoic acid Traditional Name: 2-[3-(3-bromophenyl)propanoylamino]-2-methyl-valeric acid Formula: C15H20BrNO3 MolecularWeight: 342.2282

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C)(C(=O)O)NC(=O)CCC1=CC(=CC=C1)Br

Isomeric SMILES

CCCC(C)(C(=O)O)NC(=O)CCC1=CC(=CC=C1)Br

InChI

InChI=1S/C15H20BrNO3/c1-3-9-15(2,14(19)20)17-13(18)8-7-11-5-4-6-12(16)10-11/h4-6,10H,3,7-9H2,1-2H3,(H,17,18)(H,19,20)