6-[(5-chloranyl-2-methoxycarbonyl-phenyl)amino]-6-oxidanylidene-hexanoic acid

Systemtic Name: 6-[(5-chloranyl-2-methoxycarbonyl-phenyl)amino]-6-oxidanylidene-hexanoic acid Openeye Name: 6-(5-chloro-2-methoxycarbonyl-anilino)-6-oxo-hexanoic acid CAS Name: 6-(5-chloro-2-methoxycarbonylanilino)-6-oxohexanoic acid IUPAC Name: 6-(5-chloro-2-methoxycarbonylanilino)-6-oxohexanoic acid Traditional Name: 6-(2-carbomethoxy-5-chloro-anilino)-6-keto-hexanoic acid Formula: C14H16ClNO5 MolecularWeight: 313.73354

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(C=C(C=C1)Cl)NC(=O)CCCCC(=O)O

Isomeric SMILES

COC(=O)C1=C(C=C(C=C1)Cl)NC(=O)CCCCC(=O)O

InChI

InChI=1S/C14H16ClNO5/c1-21-14(20)10-7-6-9(15)8-11(10)16-12(17)4-2-3-5-13(18)19/h6-8H,2-5H2,1H3,(H,16,17)(H,18,19)