6-[5-(7-propyl-1-benzofuran-2-yl)-1H-pyrrol-2-yl]naphthalene-2-carboxylic acid

Systemtic Name: 6-[5-(7-propyl-1-benzofuran-2-yl)-1H-pyrrol-2-yl]naphthalene-2-carboxylic acid Openeye Name: 6-[5-(7-propylbenzofuran-2-yl)-1H-pyrrol-2-yl]naphthalene-2-carboxylic acid CAS Name: 6-[5-(7-propyl-2-benzofuranyl)-1H-pyrrol-2-yl]-2-naphthalenecarboxylic acid IUPAC Name: 6-[5-(7-propyl-1-benzofuran-2-yl)-1H-pyrrol-2-yl]naphthalene-2-carboxylic acid Traditional Name: 6-[5-(7-propylbenzofuran-2-yl)-1H-pyrrol-2-yl]-2-naphthoic acid Formula: C26H21NO3 MolecularWeight: 395.44984

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC=CC2=C1OC(=C2)C3=CC=C(N3)C4=CC5=C(C=C4)C=C(C=C5)C(=O)O

Isomeric SMILES

CCCC1=CC=CC2=C1OC(=C2)C3=CC=C(N3)C4=CC5=C(C=C4)C=C(C=C5)C(=O)O

InChI

InChI=1S/C26H21NO3/c1-2-4-16-5-3-6-20-15-24(30-25(16)20)23-12-11-22(27-23)19-9-7-18-14-21(26(28)29)10-8-17(18)13-19/h3,5-15,27H,2,4H2,1H3,(H,28,29)