5-[(4-bromanyl-2,6-dimethyl-phenyl)carbamoylamino]-5-oxidanylidene-pentanoic acid

Systemtic Name: 5-[(4-bromanyl-2,6-dimethyl-phenyl)carbamoylamino]-5-oxidanylidene-pentanoic acid Openeye Name: 5-[(4-bromo-2,6-dimethyl-phenyl)carbamoylamino]-5-oxo-pentanoic acid CAS Name: 5-[[(4-bromo-2,6-dimethylanilino)-oxomethyl]amino]-5-oxopentanoic acid IUPAC Name: 5-[(4-bromo-2,6-dimethylphenyl)carbamoylamino]-5-oxopentanoic acid Traditional Name: 5-[(4-bromo-2,6-dimethyl-phenyl)carbamoylamino]-5-keto-valeric acid Formula: C14H17BrN2O4 MolecularWeight: 357.19978

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1NC(=O)NC(=O)CCCC(=O)O)C)Br

Isomeric SMILES

CC1=CC(=CC(=C1NC(=O)NC(=O)CCCC(=O)O)C)Br

InChI

InChI=1S/C14H17BrN2O4/c1-8-6-10(15)7-9(2)13(8)17-14(21)16-11(18)4-3-5-12(19)20/h6-7H,3-5H2,1-2H3,(H,19,20)(H2,16,17,18,21)