4-[3-[(3-chloranyl-4-methyl-phenyl)amino]propoxy]benzoic acid

Systemtic Name: 4-[3-[(3-chloranyl-4-methyl-phenyl)amino]propoxy]benzoic acid Openeye Name: 4-[3-(3-chloro-4-methyl-anilino)propoxy]benzoic acid CAS Name: 4-[3-(3-chloro-4-methylanilino)propoxy]benzoic acid IUPAC Name: 4-[3-(3-chloro-4-methylanilino)propoxy]benzoic acid Traditional Name: 4-[3-(3-chloro-4-methyl-anilino)propoxy]benzoic acid Formula: C17H18ClNO3 MolecularWeight: 319.78272

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H18ClNO3/c1-12-3-6-14(11-16(12)18)19-9-2-10-22-15-7-4-13(5-8-15)17(20)21/h3-8,11,19H,2,9-10H2,1H3,(H,20,21)