4-[4-[[butyl(2-phenylethanoyl)amino]methyl]phenyl]benzoic acid

Systemtic Name: 4-[4-[[butyl(2-phenylethanoyl)amino]methyl]phenyl]benzoic acid Openeye Name: 4-[4-[[butyl-(2-phenylacetyl)amino]methyl]phenyl]benzoic acid CAS Name: 4-[4-[[butyl-(1-oxo-2-phenylethyl)amino]methyl]phenyl]benzoic acid IUPAC Name: 4-[4-[[butyl-(2-phenylacetyl)amino]methyl]phenyl]benzoic acid Traditional Name: 4-[4-[[butyl-(2-phenylacetyl)amino]methyl]phenyl]benzoic acid Formula: C26H27NO3 MolecularWeight: 401.49748

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN(CC1=CC=C(C=C1)C2=CC=C(C=C2)C(=O)O)C(=O)CC3=CC=CC=C3

Isomeric SMILES

CCCCN(CC1=CC=C(C=C1)C2=CC=C(C=C2)C(=O)O)C(=O)CC3=CC=CC=C3

InChI

InChI=1S/C26H27NO3/c1-2-3-17-27(25(28)18-20-7-5-4-6-8-20)19-21-9-11-22(12-10-21)23-13-15-24(16-14-23)26(29)30/h4-16H,2-3,17-19H2,1H3,(H,29,30)