4-[1-(2-dimethylaminoethyl)-2-(furan-2-yl)-5-phenyl-pyrrol-3-yl]benzoic acid

Systemtic Name: 4-[1-(2-dimethylaminoethyl)-2-(furan-2-yl)-5-phenyl-pyrrol-3-yl]benzoic acid Openeye Name: 4-[1-(2-dimethylaminoethyl)-2-(2-furyl)-5-phenyl-pyrrol-3-yl]benzoic acid CAS Name: 4-[1-(2-dimethylaminoethyl)-2-(2-furanyl)-5-phenyl-3-pyrrolyl]benzoic acid IUPAC Name: 4-[1-(2-dimethylaminoethyl)-2-(furan-2-yl)-5-phenylpyrrol-3-yl]benzoic acid Traditional Name: 4-[1-(2-dimethylaminoethyl)-2-(2-furyl)-5-phenyl-pyrrol-3-yl]benzoic acid Formula: C25H24N2O3 MolecularWeight: 400.46966

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)CCN1C(=CC(=C1C2=CC=CO2)C3=CC=C(C=C3)C(=O)O)C4=CC=CC=C4

Isomeric SMILES

CN(C)CCN1C(=CC(=C1C2=CC=CO2)C3=CC=C(C=C3)C(=O)O)C4=CC=CC=C4

InChI

InChI=1S/C25H24N2O3/c1-26(2)14-15-27-22(19-7-4-3-5-8-19)17-21(24(27)23-9-6-16-30-23)18-10-12-20(13-11-18)25(28)29/h3-13,16-17H,14-15H2,1-2H3,(H,28,29)