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

Systemtic Name: 2-[4-[3,5-bis(chloranyl)phenoxy]butylamino]-5-methyl-benzoic acid Openeye Name: 2-[4-(3,5-dichlorophenoxy)butylamino]-5-methyl-benzoic acid CAS Name: 2-[4-(3,5-dichlorophenoxy)butylamino]-5-methylbenzoic acid IUPAC Name: 2-[4-(3,5-dichlorophenoxy)butylamino]-5-methylbenzoic acid Traditional Name: 2-[4-(3,5-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=CC(=CC(=C2)Cl)Cl)C(=O)O

Isomeric SMILES

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

InChI

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