4-tert-butyl-3-(phenylmethyl)-1H-1,3,4-benzotriazepine-2,5-dione

Systemtic Name: 4-tert-butyl-3-(phenylmethyl)-1H-1,3,4-benzotriazepine-2,5-dione Openeye Name: 3-benzyl-4-tert-butyl-1H-1,3,4-benzotriazepine-2,5-dione CAS Name: 4-tert-butyl-3-(phenylmethyl)-1H-1,3,4-benzotriazepine-2,5-dione IUPAC Name: 3-benzyl-4-tert-butyl-1H-1,3,4-benzotriazepine-2,5-dione Traditional Name: 3-benzyl-4-tert-butyl-1H-1,3,4-benzotriazepine-2,5-quinone Formula: C19H21N3O2 MolecularWeight: 323.38894

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)N1C(=O)C2=CC=CC=C2NC(=O)N1CC3=CC=CC=C3

Isomeric SMILES

CC(C)(C)N1C(=O)C2=CC=CC=C2NC(=O)N1CC3=CC=CC=C3

InChI

InChI=1S/C19H21N3O2/c1-19(2,3)22-17(23)15-11-7-8-12-16(15)20-18(24)21(22)13-14-9-5-4-6-10-14/h4-12H,13H2,1-3H3,(H,20,24)