(E)-3-[4-(5-aminocarbonyl-1-cyclopentyl-benzimidazol-2-yl)phenyl]prop-2-enoic acid

Systemtic Name: (E)-3-[4-(5-aminocarbonyl-1-cyclopentyl-benzimidazol-2-yl)phenyl]prop-2-enoic acid Openeye Name: (E)-3-[4-(5-carbamoyl-1-cyclopentyl-benzimidazol-2-yl)phenyl]prop-2-enoic acid CAS Name: (E)-3-[4-(5-carbamoyl-1-cyclopentyl-2-benzimidazolyl)phenyl]-2-propenoic acid IUPAC Name: (E)-3-[4-(5-carbamoyl-1-cyclopentylbenzimidazol-2-yl)phenyl]prop-2-enoic acid Traditional Name: (E)-3-[4-(5-carbamoyl-1-cyclopentyl-benzimidazol-2-yl)phenyl]acrylic acid Formula: C22H21N3O3 MolecularWeight: 375.42044

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)N2C3=C(C=C(C=C3)C(=O)N)N=C2C4=CC=C(C=C4)C=CC(=O)O

Isomeric SMILES

C1CCC(C1)N2C3=C(C=C(C=C3)C(=O)N)N=C2C4=CC=C(C=C4)/C=C/C(=O)O

InChI

InChI=1S/C22H21N3O3/c23-21(28)16-10-11-19-18(13-16)24-22(25(19)17-3-1-2-4-17)15-8-5-14(6-9-15)7-12-20(26)27/h5-13,17H,1-4H2,(H2,23,28)(H,26,27)/b12-7+