6-[(4-chloranyl-2-methoxy-5-methyl-phenyl)amino]-6-oxidanylidene-hexanoic acid

Systemtic Name: 6-[(4-chloranyl-2-methoxy-5-methyl-phenyl)amino]-6-oxidanylidene-hexanoic acid Openeye Name: 6-(4-chloro-2-methoxy-5-methyl-anilino)-6-oxo-hexanoic acid CAS Name: 6-(4-chloro-2-methoxy-5-methylanilino)-6-oxohexanoic acid IUPAC Name: 6-(4-chloro-2-methoxy-5-methylanilino)-6-oxohexanoic acid Traditional Name: 6-(4-chloro-2-methoxy-5-methyl-anilino)-6-keto-hexanoic acid Formula: C14H18ClNO4 MolecularWeight: 299.75002

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1Cl)OC)NC(=O)CCCCC(=O)O

Isomeric SMILES

CC1=CC(=C(C=C1Cl)OC)NC(=O)CCCCC(=O)O

InChI

InChI=1S/C14H18ClNO4/c1-9-7-11(12(20-2)8-10(9)15)16-13(17)5-3-4-6-14(18)19/h7-8H,3-6H2,1-2H3,(H,16,17)(H,18,19)