5-[(4-bromanyl-2-methyl-phenyl)amino]-5-oxidanylidene-pentanoate

Systemtic Name: 5-[(4-bromanyl-2-methyl-phenyl)amino]-5-oxidanylidene-pentanoate Openeye Name: 5-(4-bromo-2-methyl-anilino)-5-oxo-pentanoate CAS Name: 5-(4-bromo-2-methylanilino)-5-oxopentanoate IUPAC Name: 5-(4-bromo-2-methylanilino)-5-oxopentanoate Traditional Name: 5-(4-bromo-2-methyl-anilino)-5-keto-valerate Formula: C12H13BrNO3- MolecularWeight: 299.14052

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)Br)NC(=O)CCCC(=O)[O-]

Isomeric SMILES

CC1=C(C=CC(=C1)Br)NC(=O)CCCC(=O)[O-]

InChI

InChI=1S/C12H14BrNO3/c1-8-7-9(13)5-6-10(8)14-11(15)3-2-4-12(16)17/h5-7H,2-4H2,1H3,(H,14,15)(H,16,17)/p-1