3-[2-[4-(4-imidazol-1-ylphenoxy)butoxy]carbazol-9-yl]propanoic acid

Systemtic Name: 3-[2-[4-(4-imidazol-1-ylphenoxy)butoxy]carbazol-9-yl]propanoic acid Openeye Name: 3-[2-[4-(4-imidazol-1-ylphenoxy)butoxy]carbazol-9-yl]propanoic acid CAS Name: 3-[2-[4-[4-(1-imidazolyl)phenoxy]butoxy]-9-carbazolyl]propanoic acid IUPAC Name: 3-[2-[4-(4-imidazol-1-ylphenoxy)butoxy]carbazol-9-yl]propanoic acid Traditional Name: 3-[2-[4-(4-imidazol-1-ylphenoxy)butoxy]carbazol-9-yl]propionic acid Formula: C28H27N3O4 MolecularWeight: 469.53168

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C3=C(N2CCC(=O)O)C=C(C=C3)OCCCCOC4=CC=C(C=C4)N5C=CN=C5

Isomeric SMILES

C1=CC=C2C(=C1)C3=C(N2CCC(=O)O)C=C(C=C3)OCCCCOC4=CC=C(C=C4)N5C=CN=C5

InChI

InChI=1S/C28H27N3O4/c32-28(33)13-15-31-26-6-2-1-5-24(26)25-12-11-23(19-27(25)31)35-18-4-3-17-34-22-9-7-21(8-10-22)30-16-14-29-20-30/h1-2,5-12,14,16,19-20H,3-4,13,15,17-18H2,(H,32,33)