2-[2-[(2-chloranyl-6-fluoranyl-phenyl)amino]-5-methyl-phenyl]butanedioic acid

Systemtic Name: 2-[2-[(2-chloranyl-6-fluoranyl-phenyl)amino]-5-methyl-phenyl]butanedioic acid Openeye Name: 2-[2-(2-chloro-6-fluoro-anilino)-5-methyl-phenyl]butanedioic acid CAS Name: 2-[2-(2-chloro-6-fluoroanilino)-5-methylphenyl]butanedioic acid IUPAC Name: 2-[2-(2-chloro-6-fluoroanilino)-5-methylphenyl]butanedioic acid Traditional Name: 2-[2-(2-chloro-6-fluoro-anilino)-5-methyl-phenyl]succinic acid Formula: C17H15ClFNO4 MolecularWeight: 351.756703

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)NC2=C(C=CC=C2Cl)F)C(CC(=O)O)C(=O)O

Isomeric SMILES

CC1=CC(=C(C=C1)NC2=C(C=CC=C2Cl)F)C(CC(=O)O)C(=O)O

InChI

InChI=1S/C17H15ClFNO4/c1-9-5-6-14(20-16-12(18)3-2-4-13(16)19)10(7-9)11(17(23)24)8-15(21)22/h2-7,11,20H,8H2,1H3,(H,21,22)(H,23,24)