3-[1-(4-phenyldiazenylphenyl)-5-thiophen-2-yl-pyrrol-2-yl]propanoic acid

Systemtic Name: 3-[1-(4-phenyldiazenylphenyl)-5-thiophen-2-yl-pyrrol-2-yl]propanoic acid Openeye Name: 3-[1-(4-phenylazophenyl)-5-(2-thienyl)pyrrol-2-yl]propanoic acid CAS Name: 3-[1-(4-phenyldiazenylphenyl)-5-thiophen-2-yl-2-pyrrolyl]propanoic acid IUPAC Name: 3-[1-(4-phenyldiazenylphenyl)-5-thiophen-2-ylpyrrol-2-yl]propanoic acid Traditional Name: 3-[1-(4-phenylazophenyl)-5-(2-thienyl)pyrrol-2-yl]propionic acid Formula: C23H19N3O2S MolecularWeight: 401.48086

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N=NC2=CC=C(C=C2)N3C(=CC=C3C4=CC=CS4)CCC(=O)O

Isomeric SMILES

C1=CC=C(C=C1)N=NC2=CC=C(C=C2)N3C(=CC=C3C4=CC=CS4)CCC(=O)O

InChI

InChI=1S/C23H19N3O2S/c27-23(28)15-13-20-12-14-21(22-7-4-16-29-22)26(20)19-10-8-18(9-11-19)25-24-17-5-2-1-3-6-17/h1-12,14,16H,13,15H2,(H,27,28)