6-[(4-chloranyl-2,5-dimethoxy-phenyl)amino]-6-oxidanylidene-hexanoic acid

Systemtic Name: 6-[(4-chloranyl-2,5-dimethoxy-phenyl)amino]-6-oxidanylidene-hexanoic acid Openeye Name: 6-(4-chloro-2,5-dimethoxy-anilino)-6-oxo-hexanoic acid CAS Name: 6-(4-chloro-2,5-dimethoxyanilino)-6-oxohexanoic acid IUPAC Name: 6-(4-chloro-2,5-dimethoxyanilino)-6-oxohexanoic acid Traditional Name: 6-(4-chloro-2,5-dimethoxy-anilino)-6-keto-hexanoic acid Formula: C14H18ClNO5 MolecularWeight: 315.74942

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1NC(=O)CCCCC(=O)O)OC)Cl

Isomeric SMILES

COC1=CC(=C(C=C1NC(=O)CCCCC(=O)O)OC)Cl

InChI

InChI=1S/C14H18ClNO5/c1-20-11-8-10(12(21-2)7-9(11)15)16-13(17)5-3-4-6-14(18)19/h7-8H,3-6H2,1-2H3,(H,16,17)(H,18,19)