3-[1-[3-(2-methyl-2,3-dihydro-1-benzofuran-5-yl)propylcarbamoyl]cyclohexyl]propanoic acid

Systemtic Name: 3-[1-[3-(2-methyl-2,3-dihydro-1-benzofuran-5-yl)propylcarbamoyl]cyclohexyl]propanoic acid Openeye Name: 3-[1-[3-(2-methyl-2,3-dihydrobenzofuran-5-yl)propylcarbamoyl]cyclohexyl]propanoic acid CAS Name: 3-[1-[[3-(2-methyl-2,3-dihydrobenzofuran-5-yl)propylamino]-oxomethyl]cyclohexyl]propanoic acid IUPAC Name: 3-[1-[3-(2-methyl-2,3-dihydro-1-benzofuran-5-yl)propylcarbamoyl]cyclohexyl]propanoic acid Traditional Name: 3-[1-[3-(2-methylcoumaran-5-yl)propylcarbamoyl]cyclohexyl]propionic acid Formula: C22H31NO4 MolecularWeight: 373.48584

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC2=C(O1)C=CC(=C2)CCCNC(=O)C3(CCCCC3)CCC(=O)O

Isomeric SMILES

CC1CC2=C(O1)C=CC(=C2)CCCNC(=O)C3(CCCCC3)CCC(=O)O

InChI

InChI=1S/C22H31NO4/c1-16-14-18-15-17(7-8-19(18)27-16)6-5-13-23-21(26)22(12-9-20(24)25)10-3-2-4-11-22/h7-8,15-16H,2-6,9-14H2,1H3,(H,23,26)(H,24,25)