5-azanyl-2-[(4-bromanyl-3-methyl-phenyl)sulfonylamino]-5-oxidanylidene-pentanoic acid

Systemtic Name: 5-azanyl-2-[(4-bromanyl-3-methyl-phenyl)sulfonylamino]-5-oxidanylidene-pentanoic acid Openeye Name: 5-amino-2-[(4-bromo-3-methyl-phenyl)sulfonylamino]-5-oxo-pentanoic acid CAS Name: 5-amino-2-[(4-bromo-3-methylphenyl)sulfonylamino]-5-oxopentanoic acid IUPAC Name: 5-amino-2-[(4-bromo-3-methylphenyl)sulfonylamino]-5-oxopentanoic acid Traditional Name: 5-amino-2-[(4-bromo-3-methyl-phenyl)sulfonylamino]-5-keto-valeric acid Formula: C12H15BrN2O5S MolecularWeight: 379.2269

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)S(=O)(=O)NC(CCC(=O)N)C(=O)O)Br

Isomeric SMILES

CC1=C(C=CC(=C1)S(=O)(=O)NC(CCC(=O)N)C(=O)O)Br

InChI

InChI=1S/C12H15BrN2O5S/c1-7-6-8(2-3-9(7)13)21(19,20)15-10(12(17)18)4-5-11(14)16/h2-3,6,10,15H,4-5H2,1H3,(H2,14,16)(H,17,18)