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

Systemtic Name: 3-chloranyl-2-[4-(4-chloranyl-3,5-dimethyl-phenoxy)butylamino]benzoic acid Openeye Name: 3-chloro-2-[4-(4-chloro-3,5-dimethyl-phenoxy)butylamino]benzoic acid CAS Name: 3-chloro-2-[4-(4-chloro-3,5-dimethylphenoxy)butylamino]benzoic acid IUPAC Name: 3-chloro-2-[4-(4-chloro-3,5-dimethylphenoxy)butylamino]benzoic acid Traditional Name: 3-chloro-2-[4-(4-chloro-3,5-dimethyl-phenoxy)butylamino]benzoic acid Formula: C19H21Cl2NO3 MolecularWeight: 382.28094

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1Cl)C)OCCCCNC2=C(C=CC=C2Cl)C(=O)O

Isomeric SMILES

CC1=CC(=CC(=C1Cl)C)OCCCCNC2=C(C=CC=C2Cl)C(=O)O

InChI

InChI=1S/C19H21Cl2NO3/c1-12-10-14(11-13(2)17(12)21)25-9-4-3-8-22-18-15(19(23)24)6-5-7-16(18)20/h5-7,10-11,22H,3-4,8-9H2,1-2H3,(H,23,24)