2-[2,3-bis(chloranyl)-4-[3-(dimethylaminomethyl)-4-oxidanyl-phenyl]carbonyl-phenoxy]ethanoic acid

Systemtic Name: 2-[2,3-bis(chloranyl)-4-[3-(dimethylaminomethyl)-4-oxidanyl-phenyl]carbonyl-phenoxy]ethanoic acid Openeye Name: 2-[2,3-dichloro-4-[3-(dimethylaminomethyl)-4-hydroxy-benzoyl]phenoxy]acetic acid CAS Name: 2-[2,3-dichloro-4-[[3-(dimethylaminomethyl)-4-hydroxyphenyl]-oxomethyl]phenoxy]acetic acid IUPAC Name: 2-[2,3-dichloro-4-[3-(dimethylaminomethyl)-4-hydroxybenzoyl]phenoxy]acetic acid Traditional Name: 2-[2,3-dichloro-4-[3-(dimethylaminomethyl)-4-hydroxy-benzoyl]phenoxy]acetic acid Formula: C18H17Cl2NO5 MolecularWeight: 398.23728

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)CC1=C(C=CC(=C1)C(=O)C2=C(C(=C(C=C2)OCC(=O)O)Cl)Cl)O

Isomeric SMILES

CN(C)CC1=C(C=CC(=C1)C(=O)C2=C(C(=C(C=C2)OCC(=O)O)Cl)Cl)O

InChI

InChI=1S/C18H17Cl2NO5/c1-21(2)8-11-7-10(3-5-13(11)22)18(25)12-4-6-14(17(20)16(12)19)26-9-15(23)24/h3-7,22H,8-9H2,1-2H3,(H,23,24)