4-[5-(5-ethyl-2H-chromen-3-yl)-1H-pyrrol-2-yl]benzoic acid

Systemtic Name: 4-[5-(5-ethyl-2H-chromen-3-yl)-1H-pyrrol-2-yl]benzoic acid Openeye Name: 4-[5-(5-ethyl-2H-chromen-3-yl)-1H-pyrrol-2-yl]benzoic acid CAS Name: 4-[5-(5-ethyl-2H-1-benzopyran-3-yl)-1H-pyrrol-2-yl]benzoic acid IUPAC Name: 4-[5-(5-ethyl-2H-chromen-3-yl)-1H-pyrrol-2-yl]benzoic acid Traditional Name: 4-[5-(5-ethyl-2H-chromen-3-yl)-1H-pyrrol-2-yl]benzoic acid Formula: C22H19NO3 MolecularWeight: 345.39116

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C2C=C(COC2=CC=C1)C3=CC=C(N3)C4=CC=C(C=C4)C(=O)O

Isomeric SMILES

CCC1=C2C=C(COC2=CC=C1)C3=CC=C(N3)C4=CC=C(C=C4)C(=O)O

InChI

InChI=1S/C22H19NO3/c1-2-14-4-3-5-21-18(14)12-17(13-26-21)20-11-10-19(23-20)15-6-8-16(9-7-15)22(24)25/h3-12,23H,2,13H2,1H3,(H,24,25)