2-[[4-[3-(4-pyrrol-1-ylphenyl)propyl]phenyl]amino]benzoic acid

Systemtic Name: 2-[[4-[3-(4-pyrrol-1-ylphenyl)propyl]phenyl]amino]benzoic acid Openeye Name: 2-[4-[3-(4-pyrrol-1-ylphenyl)propyl]anilino]benzoic acid CAS Name: 2-[4-[3-[4-(1-pyrrolyl)phenyl]propyl]anilino]benzoic acid IUPAC Name: 2-[4-[3-(4-pyrrol-1-ylphenyl)propyl]anilino]benzoic acid Traditional Name: 2-[4-[3-(4-pyrrol-1-ylphenyl)propyl]anilino]benzoic acid Formula: C26H24N2O2 MolecularWeight: 396.48096

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C(=O)O)NC2=CC=C(C=C2)CCCC3=CC=C(C=C3)N4C=CC=C4

Isomeric SMILES

C1=CC=C(C(=C1)C(=O)O)NC2=CC=C(C=C2)CCCC3=CC=C(C=C3)N4C=CC=C4

InChI

InChI=1S/C26H24N2O2/c29-26(30)24-8-1-2-9-25(24)27-22-14-10-20(11-15-22)6-5-7-21-12-16-23(17-13-21)28-18-3-4-19-28/h1-4,8-19,27H,5-7H2,(H,29,30)