4-[3-[(4-tert-butylphenyl)-(4-chlorophenyl)carbonyl-amino]propoxy]benzoic acid

Systemtic Name: 4-[3-[(4-tert-butylphenyl)-(4-chlorophenyl)carbonyl-amino]propoxy]benzoic acid Openeye Name: 4-[3-(4-tert-butyl-N-(4-chlorobenzoyl)anilino)propoxy]benzoic acid CAS Name: 4-[3-(4-tert-butyl-N-[(4-chlorophenyl)-oxomethyl]anilino)propoxy]benzoic acid IUPAC Name: 4-[3-(4-tert-butyl-N-(4-chlorobenzoyl)anilino)propoxy]benzoic acid Traditional Name: 4-[3-(4-tert-butyl-N-(4-chlorobenzoyl)anilino)propoxy]benzoic acid Formula: C27H28ClNO4 MolecularWeight: 465.96852

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)N(CCCOC2=CC=C(C=C2)C(=O)O)C(=O)C3=CC=C(C=C3)Cl

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)N(CCCOC2=CC=C(C=C2)C(=O)O)C(=O)C3=CC=C(C=C3)Cl

InChI

InChI=1S/C27H28ClNO4/c1-27(2,3)21-9-13-23(14-10-21)29(25(30)19-5-11-22(28)12-6-19)17-4-18-33-24-15-7-20(8-16-24)26(31)32/h5-16H,4,17-18H2,1-3H3,(H,31,32)