1-[[6-(5-cyclohexyl-1-benzofuran-2-yl)pyridin-3-yl]methyl]azetidine-3-carboxylic acid

Systemtic Name: 1-[[6-(5-cyclohexyl-1-benzofuran-2-yl)pyridin-3-yl]methyl]azetidine-3-carboxylic acid Openeye Name: 1-[[6-(5-cyclohexylbenzofuran-2-yl)-3-pyridyl]methyl]azetidine-3-carboxylic acid CAS Name: 1-[[6-(5-cyclohexyl-2-benzofuranyl)-3-pyridinyl]methyl]-3-azetidinecarboxylic acid IUPAC Name: 1-[[6-(5-cyclohexyl-1-benzofuran-2-yl)pyridin-3-yl]methyl]azetidine-3-carboxylic acid Traditional Name: 1-[[6-(5-cyclohexylbenzofuran-2-yl)-3-pyridyl]methyl]azetidine-3-carboxylic acid Formula: C24H26N2O3 MolecularWeight: 390.47484

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)C2=CC3=C(C=C2)OC(=C3)C4=NC=C(C=C4)CN5CC(C5)C(=O)O

Isomeric SMILES

C1CCC(CC1)C2=CC3=C(C=C2)OC(=C3)C4=NC=C(C=C4)CN5CC(C5)C(=O)O

InChI

InChI=1S/C24H26N2O3/c27-24(28)20-14-26(15-20)13-16-6-8-21(25-12-16)23-11-19-10-18(7-9-22(19)29-23)17-4-2-1-3-5-17/h6-12,17,20H,1-5,13-15H2,(H,27,28)