4-tert-butyl-7-chloranyl-1,3-dihydro-1,3,4-benzotriazepine-2,5-dione

Systemtic Name: 4-tert-butyl-7-chloranyl-1,3-dihydro-1,3,4-benzotriazepine-2,5-dione Openeye Name: 4-tert-butyl-7-chloro-1,3-dihydro-1,3,4-benzotriazepine-2,5-dione CAS Name: 4-tert-butyl-7-chloro-1,3-dihydro-1,3,4-benzotriazepine-2,5-dione IUPAC Name: 4-tert-butyl-7-chloro-1,3-dihydro-1,3,4-benzotriazepine-2,5-dione Traditional Name: 4-tert-butyl-7-chloro-1,3-dihydro-1,3,4-benzotriazepine-2,5-quinone Formula: C12H14ClN3O2 MolecularWeight: 267.71146

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)N1C(=O)C2=C(C=CC(=C2)Cl)NC(=O)N1

Isomeric SMILES

CC(C)(C)N1C(=O)C2=C(C=CC(=C2)Cl)NC(=O)N1

InChI

InChI=1S/C12H14ClN3O2/c1-12(2,3)16-10(17)8-6-7(13)4-5-9(8)14-11(18)15-16/h4-6H,1-3H3,(H2,14,15,18)