N-[4-[5-(1-adamantyl)-1,3-bis(oxidanylidene)isoindol-2-yl]phenyl]ethanamide

Systemtic Name: N-[4-[5-(1-adamantyl)-1,3-bis(oxidanylidene)isoindol-2-yl]phenyl]ethanamide Openeye Name: N-[4-[5-(1-adamantyl)-1,3-dioxo-isoindolin-2-yl]phenyl]acetamide CAS Name: N-[4-[5-(1-adamantyl)-1,3-dioxo-2-isoindolyl]phenyl]acetamide IUPAC Name: N-[4-[5-(1-adamantyl)-1,3-dioxoisoindol-2-yl]phenyl]acetamide Traditional Name: N-[4-[5-(1-adamantyl)-1,3-diketo-isoindolin-2-yl]phenyl]acetamide Formula: C26H26N2O3 MolecularWeight: 414.49624

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC=C(C=C1)N2C(=O)C3=C(C2=O)C=C(C=C3)C45CC6CC(C4)CC(C6)C5

Isomeric SMILES

CC(=O)NC1=CC=C(C=C1)N2C(=O)C3=C(C2=O)C=C(C=C3)C45CC6CC(C4)CC(C6)C5

InChI

InChI=1S/C26H26N2O3/c1-15(29)27-20-3-5-21(6-4-20)28-24(30)22-7-2-19(11-23(22)25(28)31)26-12-16-8-17(13-26)10-18(9-16)14-26/h2-7,11,16-18H,8-10,12-14H2,1H3,(H,27,29)