4-[3-[5-(4-methylphenyl)furan-2-yl]propanoylamino]benzoic acid

Systemtic Name: 4-[3-[5-(4-methylphenyl)furan-2-yl]propanoylamino]benzoic acid Openeye Name: 4-[3-[5-(p-tolyl)-2-furyl]propanoylamino]benzoic acid CAS Name: 4-[[3-[5-(4-methylphenyl)-2-furanyl]-1-oxopropyl]amino]benzoic acid IUPAC Name: 4-[3-[5-(4-methylphenyl)furan-2-yl]propanoylamino]benzoic acid Traditional Name: 4-[3-[5-(p-tolyl)-2-furyl]propanoylamino]benzoic acid Formula: C21H19NO4 MolecularWeight: 349.37986

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=CC=C(O2)CCC(=O)NC3=CC=C(C=C3)C(=O)O

Isomeric SMILES

CC1=CC=C(C=C1)C2=CC=C(O2)CCC(=O)NC3=CC=C(C=C3)C(=O)O

InChI

InChI=1S/C21H19NO4/c1-14-2-4-15(5-3-14)19-12-10-18(26-19)11-13-20(23)22-17-8-6-16(7-9-17)21(24)25/h2-10,12H,11,13H2,1H3,(H,22,23)(H,24,25)