4-[3-[(4-chlorophenyl)-(2-methylprop-2-enyl)amino]propoxy]benzoic acid

Systemtic Name: 4-[3-[(4-chlorophenyl)-(2-methylprop-2-enyl)amino]propoxy]benzoic acid Openeye Name: 4-[3-[4-chloro-N-(2-methylallyl)anilino]propoxy]benzoic acid CAS Name: 4-[3-[4-chloro-N-(2-methylprop-2-enyl)anilino]propoxy]benzoic acid IUPAC Name: 4-[3-[4-chloro-N-(2-methylprop-2-enyl)anilino]propoxy]benzoic acid Traditional Name: 4-[3-[4-chloro-N-(2-methylallyl)anilino]propoxy]benzoic acid Formula: C20H22ClNO3 MolecularWeight: 359.84658

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Descriptors Computed from Structure

Canonical SMILES:

CC(=C)CN(CCCOC1=CC=C(C=C1)C(=O)O)C2=CC=C(C=C2)Cl

Isomeric SMILES

CC(=C)CN(CCCOC1=CC=C(C=C1)C(=O)O)C2=CC=C(C=C2)Cl

InChI

InChI=1S/C20H22ClNO3/c1-15(2)14-22(18-8-6-17(21)7-9-18)12-3-13-25-19-10-4-16(5-11-19)20(23)24/h4-11H,1,3,12-14H2,2H3,(H,23,24)