2-[3-(4-chloranylphenoxy)propylamino]-3-methyl-benzoic acid

Systemtic Name: 2-[3-(4-chloranylphenoxy)propylamino]-3-methyl-benzoic acid Openeye Name: 2-[3-(4-chlorophenoxy)propylamino]-3-methyl-benzoic acid CAS Name: 2-[3-(4-chlorophenoxy)propylamino]-3-methylbenzoic acid IUPAC Name: 2-[3-(4-chlorophenoxy)propylamino]-3-methylbenzoic acid Traditional Name: 2-[3-(4-chlorophenoxy)propylamino]-3-methyl-benzoic acid Formula: C17H18ClNO3 MolecularWeight: 319.78272

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1NCCCOC2=CC=C(C=C2)Cl)C(=O)O

Isomeric SMILES

CC1=CC=CC(=C1NCCCOC2=CC=C(C=C2)Cl)C(=O)O

InChI

InChI=1S/C17H18ClNO3/c1-12-4-2-5-15(17(20)21)16(12)19-10-3-11-22-14-8-6-13(18)7-9-14/h2,4-9,19H,3,10-11H2,1H3,(H,20,21)