(5S,7R)-N-(2,3-dihydro-1,4-benzodioxin-6-yl)-3-oxidanyl-adamantane-1-carboxamide

Systemtic Name: (5S,7R)-N-(2,3-dihydro-1,4-benzodioxin-6-yl)-3-oxidanyl-adamantane-1-carboxamide Openeye Name: (5S,7R)-N-(2,3-dihydro-1,4-benzodioxin-6-yl)-3-hydroxy-adamantane-1-carboxamide CAS Name: (5S,7R)-N-(2,3-dihydro-1,4-benzodioxin-6-yl)-3-hydroxy-1-adamantanecarboxamide IUPAC Name: (5S,7R)-N-(2,3-dihydro-1,4-benzodioxin-6-yl)-3-hydroxyadamantane-1-carboxamide Traditional Name: (5S,7R)-N-(2,3-dihydro-1,4-benzodioxin-6-yl)-3-hydroxy-adamantane-1-carboxamide Formula: C19H23NO4 MolecularWeight: 329.39022

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C(O1)C=CC(=C2)NC(=O)C34CC5CC(C3)CC(C5)(C4)O

Isomeric SMILES

C1COC2=C(O1)C=CC(=C2)NC(=O)C34C[C@H]5C[C@@H](C3)CC(C5)(C4)O

InChI

InChI=1S/C19H23NO4/c21-17(20-14-1-2-15-16(6-14)24-4-3-23-15)18-7-12-5-13(8-18)10-19(22,9-12)11-18/h1-2,6,12-13,22H,3-5,7-11H2,(H,20,21)/t12-,13+,18?,19?