2-[(3aS,7aS)-1,3-bis(oxidanylidene)-3a,4,7,7a-tetrahydroisoindol-2-yl]-N-[4-(1-adamantyl)phenyl]ethanamide

Systemtic Name: 2-[(3aS,7aS)-1,3-bis(oxidanylidene)-3a,4,7,7a-tetrahydroisoindol-2-yl]-N-[4-(1-adamantyl)phenyl]ethanamide Openeye Name: 2-[(3aS,7aS)-1,3-dioxo-3a,4,7,7a-tetrahydroisoindol-2-yl]-N-[4-(1-adamantyl)phenyl]acetamide CAS Name: 2-[(3aS,7aS)-1,3-dioxo-3a,4,7,7a-tetrahydroisoindol-2-yl]-N-[4-(1-adamantyl)phenyl]acetamide IUPAC Name: 2-[(3aS,7aS)-1,3-dioxo-3a,4,7,7a-tetrahydroisoindol-2-yl]-N-[4-(1-adamantyl)phenyl]acetamide Traditional Name: 2-[(3aS,7aS)-1,3-diketo-3a,4,7,7a-tetrahydroisoindol-2-yl]-N-[4-(1-adamantyl)phenyl]acetamide Formula: C26H30N2O3 MolecularWeight: 418.528

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Descriptors Computed from Structure

Canonical SMILES:

C1C=CCC2C1C(=O)N(C2=O)CC(=O)NC3=CC=C(C=C3)C45CC6CC(C4)CC(C6)C5

Isomeric SMILES

C1C=CC[C@H]2[C@H]1C(=O)N(C2=O)CC(=O)NC3=CC=C(C=C3)C45CC6CC(C4)CC(C6)C5

InChI

InChI=1S/C26H30N2O3/c29-23(15-28-24(30)21-3-1-2-4-22(21)25(28)31)27-20-7-5-19(6-8-20)26-12-16-9-17(13-26)11-18(10-16)14-26/h1-2,5-8,16-18,21-22H,3-4,9-15H2,(H,27,29)/t16?,17?,18?,21-,22-,26?/m0/s1