5-[2-(1-adamantyl)ethylamino]-1-phenyl-1,5-benzodiazepine-2,4-dione

Systemtic Name: 5-[2-(1-adamantyl)ethylamino]-1-phenyl-1,5-benzodiazepine-2,4-dione Openeye Name: 5-[2-(1-adamantyl)ethylamino]-1-phenyl-1,5-benzodiazepine-2,4-dione CAS Name: 5-[2-(1-adamantyl)ethylamino]-1-phenyl-1,5-benzodiazepine-2,4-dione IUPAC Name: 5-[2-(1-adamantyl)ethylamino]-1-phenyl-1,5-benzodiazepine-2,4-dione Traditional Name: 5-[2-(1-adamantyl)ethylamino]-1-phenyl-1,5-benzodiazepine-2,4-quinone Formula: C27H31N3O2 MolecularWeight: 429.55394

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)(C3)CCNN4C(=O)CC(=O)N(C5=CC=CC=C54)C6=CC=CC=C6

Isomeric SMILES

C1C2CC3CC1CC(C2)(C3)CCNN4C(=O)CC(=O)N(C5=CC=CC=C54)C6=CC=CC=C6

InChI

InChI=1S/C27H31N3O2/c31-25-15-26(32)30(24-9-5-4-8-23(24)29(25)22-6-2-1-3-7-22)28-11-10-27-16-19-12-20(17-27)14-21(13-19)18-27/h1-9,19-21,28H,10-18H2