4-(4-chloranyl-3-methyl-phenyl)-4-oxidanylidene-butanoate

Systemtic Name: 4-(4-chloranyl-3-methyl-phenyl)-4-oxidanylidene-butanoate Openeye Name: 4-(4-chloro-3-methyl-phenyl)-4-oxo-butanoate CAS Name: 4-(4-chloro-3-methylphenyl)-4-oxobutanoate IUPAC Name: 4-(4-chloro-3-methylphenyl)-4-oxobutanoate Traditional Name: 4-(4-chloro-3-methyl-phenyl)-4-keto-butyrate Formula: C11H10ClO3- MolecularWeight: 225.6483

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)C(=O)CCC(=O)[O-])Cl

Isomeric SMILES

CC1=C(C=CC(=C1)C(=O)CCC(=O)[O-])Cl

InChI

InChI=1S/C11H11ClO3/c1-7-6-8(2-3-9(7)12)10(13)4-5-11(14)15/h2-3,6H,4-5H2,1H3,(H,14,15)/p-1