5-chloranyl-2,4-bis(oxidanyl)benzoate; ethylbenzene

Systemtic Name: 5-chloranyl-2,4-bis(oxidanyl)benzoate; ethylbenzene Openeye Name: 5-chloro-2,4-dihydroxy-benzoate; ethylbenzene CAS Name: 5-chloro-2,4-dihydroxybenzoate; ethylbenzene IUPAC Name: 5-chloro-2,4-dihydroxybenzoate; ethylbenzene Traditional Name: 5-chloro-2,4-dihydroxy-benzoate; ethylbenzene Formula: C15H14ClO4- MolecularWeight: 293.72226

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC=C1.C1=C(C(=CC(=C1Cl)O)O)C(=O)[O-]

Isomeric SMILES

CCC1=CC=CC=C1.C1=C(C(=CC(=C1Cl)O)O)C(=O)[O-]

InChI

InChI=1S/C8H10.C7H5ClO4/c1-2-8-6-4-3-5-7-8;8-4-1-3(7(11)12)5(9)2-6(4)10/h3-7H,2H2,1H3;1-2,9-10H,(H,11,12)/p-1