1-(2,3-dihydro-1-benzofuran-5-ylcarbonylamino)cyclohexane-1-carboxylic acid

Systemtic Name: 1-(2,3-dihydro-1-benzofuran-5-ylcarbonylamino)cyclohexane-1-carboxylic acid Openeye Name: 1-(2,3-dihydrobenzofuran-5-carbonylamino)cyclohexanecarboxylic acid CAS Name: 1-[[2,3-dihydrobenzofuran-5-yl(oxo)methyl]amino]-1-cyclohexanecarboxylic acid IUPAC Name: 1-(2,3-dihydro-1-benzofuran-5-carbonylamino)cyclohexane-1-carboxylic acid Traditional Name: 1-(coumaran-5-carbonylamino)cyclohexanecarboxylic acid Formula: C16H19NO4 MolecularWeight: 289.32636

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)(C(=O)O)NC(=O)C2=CC3=C(C=C2)OCC3

Isomeric SMILES

C1CCC(CC1)(C(=O)O)NC(=O)C2=CC3=C(C=C2)OCC3

InChI

InChI=1S/C16H19NO4/c18-14(12-4-5-13-11(10-12)6-9-21-13)17-16(15(19)20)7-2-1-3-8-16/h4-5,10H,1-3,6-9H2,(H,17,18)(H,19,20)