2-[(4-bromanyl-2-methyl-phenyl)carbonylamino]-4-methyl-pentanoic acid

Systemtic Name: 2-[(4-bromanyl-2-methyl-phenyl)carbonylamino]-4-methyl-pentanoic acid Openeye Name: 2-[(4-bromo-2-methyl-benzoyl)amino]-4-methyl-pentanoic acid CAS Name: 2-[[(4-bromo-2-methylphenyl)-oxomethyl]amino]-4-methylpentanoic acid IUPAC Name: 2-[(4-bromo-2-methylbenzoyl)amino]-4-methylpentanoic acid Traditional Name: 2-[(4-bromo-2-methyl-benzoyl)amino]-4-methyl-valeric acid Formula: C14H18BrNO3 MolecularWeight: 328.20162

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)Br)C(=O)NC(CC(C)C)C(=O)O

Isomeric SMILES

CC1=C(C=CC(=C1)Br)C(=O)NC(CC(C)C)C(=O)O

InChI

InChI=1S/C14H18BrNO3/c1-8(2)6-12(14(18)19)16-13(17)11-5-4-10(15)7-9(11)3/h4-5,7-8,12H,6H2,1-3H3,(H,16,17)(H,18,19)