2-[4-[2,3-bis(chloranyl)phenoxy]butylamino]-5-methyl-benzoic acid

Systemtic Name: 2-[4-[2,3-bis(chloranyl)phenoxy]butylamino]-5-methyl-benzoic acid Openeye Name: 2-[4-(2,3-dichlorophenoxy)butylamino]-5-methyl-benzoic acid CAS Name: 2-[4-(2,3-dichlorophenoxy)butylamino]-5-methylbenzoic acid IUPAC Name: 2-[4-(2,3-dichlorophenoxy)butylamino]-5-methylbenzoic acid Traditional Name: 2-[4-(2,3-dichlorophenoxy)butylamino]-5-methyl-benzoic acid Formula: C18H19Cl2NO3 MolecularWeight: 368.25436

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)NCCCCOC2=C(C(=CC=C2)Cl)Cl)C(=O)O

Isomeric SMILES

CC1=CC(=C(C=C1)NCCCCOC2=C(C(=CC=C2)Cl)Cl)C(=O)O

InChI

InChI=1S/C18H19Cl2NO3/c1-12-7-8-15(13(11-12)18(22)23)21-9-2-3-10-24-16-6-4-5-14(19)17(16)20/h4-8,11,21H,2-3,9-10H2,1H3,(H,22,23)