2-[3-[(2,4-dichlorophenyl)carbonylamino]-2-methyl-4-propoxy-phenyl]-4-methyl-benzoic acid

Systemtic Name: 2-[3-[(2,4-dichlorophenyl)carbonylamino]-2-methyl-4-propoxy-phenyl]-4-methyl-benzoic acid Openeye Name: 2-[3-[(2,4-dichlorobenzoyl)amino]-2-methyl-4-propoxy-phenyl]-4-methyl-benzoic acid CAS Name: 2-[3-[[(2,4-dichlorophenyl)-oxomethyl]amino]-2-methyl-4-propoxyphenyl]-4-methylbenzoic acid IUPAC Name: 2-[3-[(2,4-dichlorobenzoyl)amino]-2-methyl-4-propoxyphenyl]-4-methylbenzoic acid Traditional Name: 2-[3-[(2,4-dichlorobenzoyl)amino]-2-methyl-4-propoxy-phenyl]-4-methyl-benzoic acid Formula: C25H23Cl2NO4 MolecularWeight: 472.36042

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=C(C(=C(C=C1)C2=C(C=CC(=C2)C)C(=O)O)C)NC(=O)C3=C(C=C(C=C3)Cl)Cl

Isomeric SMILES

CCCOC1=C(C(=C(C=C1)C2=C(C=CC(=C2)C)C(=O)O)C)NC(=O)C3=C(C=C(C=C3)Cl)Cl

InChI

InChI=1S/C25H23Cl2NO4/c1-4-11-32-22-10-9-17(20-12-14(2)5-7-18(20)25(30)31)15(3)23(22)28-24(29)19-8-6-16(26)13-21(19)27/h5-10,12-13H,4,11H2,1-3H3,(H,28,29)(H,30,31)