N-[7-[(R)-oxidanyl(phenyl)methyl]-2,3-dihydro-1,4-benzodioxin-6-yl]adamantane-1-carboxamide

Systemtic Name: N-[7-[(R)-oxidanyl(phenyl)methyl]-2,3-dihydro-1,4-benzodioxin-6-yl]adamantane-1-carboxamide Openeye Name: N-[7-[(R)-hydroxy(phenyl)methyl]-2,3-dihydro-1,4-benzodioxin-6-yl]adamantane-1-carboxamide CAS Name: N-[7-[(R)-hydroxy(phenyl)methyl]-2,3-dihydro-1,4-benzodioxin-6-yl]-1-adamantanecarboxamide IUPAC Name: N-[7-[(R)-hydroxy(phenyl)methyl]-2,3-dihydro-1,4-benzodioxin-6-yl]adamantane-1-carboxamide Traditional Name: N-[7-[(R)-hydroxy(phenyl)methyl]-2,3-dihydro-1,4-benzodioxin-6-yl]adamantane-1-carboxamide Formula: C26H29NO4 MolecularWeight: 419.51276

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C(O1)C=C(C(=C2)NC(=O)C34CC5CC(C3)CC(C5)C4)C(C6=CC=CC=C6)O

Isomeric SMILES

C1COC2=C(O1)C=C(C(=C2)NC(=O)C34CC5CC(C3)CC(C5)C4)[C@@H](C6=CC=CC=C6)O

InChI

InChI=1S/C26H29NO4/c28-24(19-4-2-1-3-5-19)20-11-22-23(31-7-6-30-22)12-21(20)27-25(29)26-13-16-8-17(14-26)10-18(9-16)15-26/h1-5,11-12,16-18,24,28H,6-10,13-15H2,(H,27,29)/t16?,17?,18?,24-,26?/m1/s1