(3S)-N-(1-adamantyl)-1-(2,3-dihydro-1,4-benzodioxin-6-yl)-5-oxidanylidene-pyrrolidine-3-carboxamide

Systemtic Name: (3S)-N-(1-adamantyl)-1-(2,3-dihydro-1,4-benzodioxin-6-yl)-5-oxidanylidene-pyrrolidine-3-carboxamide Openeye Name: (3S)-N-(1-adamantyl)-1-(2,3-dihydro-1,4-benzodioxin-6-yl)-5-oxo-pyrrolidine-3-carboxamide CAS Name: (3S)-N-(1-adamantyl)-1-(2,3-dihydro-1,4-benzodioxin-6-yl)-5-oxo-3-pyrrolidinecarboxamide IUPAC Name: (3S)-N-(1-adamantyl)-1-(2,3-dihydro-1,4-benzodioxin-6-yl)-5-oxopyrrolidine-3-carboxamide Traditional Name: (3S)-N-(1-adamantyl)-1-(2,3-dihydro-1,4-benzodioxin-6-yl)-5-keto-pyrrolidine-3-carboxamide Formula: C23H28N2O4 MolecularWeight: 396.47942

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C(O1)C=CC(=C2)N3CC(CC3=O)C(=O)NC45CC6CC(C4)CC(C6)C5

Isomeric SMILES

C1COC2=C(O1)C=CC(=C2)N3C[C@H](CC3=O)C(=O)NC45CC6CC(C4)CC(C6)C5

InChI

InChI=1S/C23H28N2O4/c26-21-8-17(13-25(21)18-1-2-19-20(9-18)29-4-3-28-19)22(27)24-23-10-14-5-15(11-23)7-16(6-14)12-23/h1-2,9,14-17H,3-8,10-13H2,(H,24,27)/t14?,15?,16?,17-,23?/m0/s1