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

Systemtic Name: 2-[3-[3,4-bis(chloranyl)phenoxy]propylamino]-5-methyl-benzoic acid Openeye Name: 2-[3-(3,4-dichlorophenoxy)propylamino]-5-methyl-benzoic acid CAS Name: 2-[3-(3,4-dichlorophenoxy)propylamino]-5-methylbenzoic acid IUPAC Name: 2-[3-(3,4-dichlorophenoxy)propylamino]-5-methylbenzoic acid Traditional Name: 2-[3-(3,4-dichlorophenoxy)propylamino]-5-methyl-benzoic acid Formula: C17H17Cl2NO3 MolecularWeight: 354.22778

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)NCCCOC2=CC(=C(C=C2)Cl)Cl)C(=O)O

Isomeric SMILES

CC1=CC(=C(C=C1)NCCCOC2=CC(=C(C=C2)Cl)Cl)C(=O)O

InChI

InChI=1S/C17H17Cl2NO3/c1-11-3-6-16(13(9-11)17(21)22)20-7-2-8-23-12-4-5-14(18)15(19)10-12/h3-6,9-10,20H,2,7-8H2,1H3,(H,21,22)