2-aminocarbonyl-4-(5-methylheptyl)-6-oxidanyl-2,3-dihydro-1-benzofuran-7-carboxylic acid

Systemtic Name: 2-aminocarbonyl-4-(5-methylheptyl)-6-oxidanyl-2,3-dihydro-1-benzofuran-7-carboxylic acid Openeye Name: 2-carbamoyl-6-hydroxy-4-(5-methylheptyl)-2,3-dihydrobenzofuran-7-carboxylic acid CAS Name: 2-carbamoyl-6-hydroxy-4-(5-methylheptyl)-2,3-dihydrobenzofuran-7-carboxylic acid IUPAC Name: 2-carbamoyl-6-hydroxy-4-(5-methylheptyl)-2,3-dihydro-1-benzofuran-7-carboxylic acid Traditional Name: 2-carbamoyl-6-hydroxy-4-(5-methylheptyl)coumaran-7-carboxylic acid Formula: C18H25NO5 MolecularWeight: 335.3948

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)CCCCC1=CC(=C(C2=C1CC(O2)C(=O)N)C(=O)O)O

Isomeric SMILES

CCC(C)CCCCC1=CC(=C(C2=C1CC(O2)C(=O)N)C(=O)O)O

InChI

InChI=1S/C18H25NO5/c1-3-10(2)6-4-5-7-11-8-13(20)15(18(22)23)16-12(11)9-14(24-16)17(19)21/h8,10,14,20H,3-7,9H2,1-2H3,(H2,19,21)(H,22,23)