1-[[3-chloranyl-4-(5-cyclopentyl-1-benzofuran-2-yl)phenyl]methyl]azetidine-3-carboxylic acid

Systemtic Name: 1-[[3-chloranyl-4-(5-cyclopentyl-1-benzofuran-2-yl)phenyl]methyl]azetidine-3-carboxylic acid Openeye Name: 1-[[3-chloro-4-(5-cyclopentylbenzofuran-2-yl)phenyl]methyl]azetidine-3-carboxylic acid CAS Name: 1-[[3-chloro-4-(5-cyclopentyl-2-benzofuranyl)phenyl]methyl]-3-azetidinecarboxylic acid IUPAC Name: 1-[[3-chloro-4-(5-cyclopentyl-1-benzofuran-2-yl)phenyl]methyl]azetidine-3-carboxylic acid Traditional Name: 1-[3-chloro-4-(5-cyclopentylbenzofuran-2-yl)benzyl]azetidine-3-carboxylic acid Formula: C24H24ClNO3 MolecularWeight: 409.90526

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)C2=CC3=C(C=C2)OC(=C3)C4=C(C=C(C=C4)CN5CC(C5)C(=O)O)Cl

Isomeric SMILES

C1CCC(C1)C2=CC3=C(C=C2)OC(=C3)C4=C(C=C(C=C4)CN5CC(C5)C(=O)O)Cl

InChI

InChI=1S/C24H24ClNO3/c25-21-9-15(12-26-13-19(14-26)24(27)28)5-7-20(21)23-11-18-10-17(6-8-22(18)29-23)16-3-1-2-4-16/h5-11,16,19H,1-4,12-14H2,(H,27,28)