4-[5-(8-methoxy-7-methyl-2H-chromen-3-yl)-1H-pyrrol-2-yl]benzoic acid

Systemtic Name: 4-[5-(8-methoxy-7-methyl-2H-chromen-3-yl)-1H-pyrrol-2-yl]benzoic acid Openeye Name: 4-[5-(8-methoxy-7-methyl-2H-chromen-3-yl)-1H-pyrrol-2-yl]benzoic acid CAS Name: 4-[5-(8-methoxy-7-methyl-2H-1-benzopyran-3-yl)-1H-pyrrol-2-yl]benzoic acid IUPAC Name: 4-[5-(8-methoxy-7-methyl-2H-chromen-3-yl)-1H-pyrrol-2-yl]benzoic acid Traditional Name: 4-[5-(8-methoxy-7-methyl-2H-chromen-3-yl)-1H-pyrrol-2-yl]benzoic acid Formula: C22H19NO4 MolecularWeight: 361.39056

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=C(C=C1)C=C(CO2)C3=CC=C(N3)C4=CC=C(C=C4)C(=O)O)OC

Isomeric SMILES

CC1=C(C2=C(C=C1)C=C(CO2)C3=CC=C(N3)C4=CC=C(C=C4)C(=O)O)OC

InChI

InChI=1S/C22H19NO4/c1-13-3-4-16-11-17(12-27-21(16)20(13)26-2)19-10-9-18(23-19)14-5-7-15(8-6-14)22(24)25/h3-11,23H,12H2,1-2H3,(H,24,25)