2-(dimethylamino)-5-[3-[4-(5-phenylpentoxy)phenyl]propanoylamino]benzoic acid

Systemtic Name: 2-(dimethylamino)-5-[3-[4-(5-phenylpentoxy)phenyl]propanoylamino]benzoic acid Openeye Name: 2-(dimethylamino)-5-[3-[4-(5-phenylpentoxy)phenyl]propanoylamino]benzoic acid CAS Name: 2-(dimethylamino)-5-[[1-oxo-3-[4-(5-phenylpentoxy)phenyl]propyl]amino]benzoic acid IUPAC Name: 2-(dimethylamino)-5-[3-[4-(5-phenylpentoxy)phenyl]propanoylamino]benzoic acid Traditional Name: 2-(dimethylamino)-5-[3-[4-(5-phenylpentoxy)phenyl]propanoylamino]benzoic acid Formula: C29H34N2O4 MolecularWeight: 474.59126

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=C(C=C(C=C1)NC(=O)CCC2=CC=C(C=C2)OCCCCCC3=CC=CC=C3)C(=O)O

Isomeric SMILES

CN(C)C1=C(C=C(C=C1)NC(=O)CCC2=CC=C(C=C2)OCCCCCC3=CC=CC=C3)C(=O)O

InChI

InChI=1S/C29H34N2O4/c1-31(2)27-18-15-24(21-26(27)29(33)34)30-28(32)19-14-23-12-16-25(17-13-23)35-20-8-4-7-11-22-9-5-3-6-10-22/h3,5-6,9-10,12-13,15-18,21H,4,7-8,11,14,19-20H2,1-2H3,(H,30,32)(H,33,34)