4-(phenylmethyl)-1,2,5,7-tetrahydro-1,4,7-benzotriazonine-3,6-dione

Systemtic Name: 4-(phenylmethyl)-1,2,5,7-tetrahydro-1,4,7-benzotriazonine-3,6-dione Openeye Name: 4-benzyl-1,2,5,7-tetrahydro-1,4,7-benzotriazonine-3,6-dione CAS Name: 4-(phenylmethyl)-1,2,5,7-tetrahydro-1,4,7-benzotriazonine-3,6-dione IUPAC Name: 4-benzyl-1,2,5,7-tetrahydro-1,4,7-benzotriazonine-3,6-dione Traditional Name: 4-benzyl-1,2,5,7-tetrahydro-1,4,7-benzotriazonine-3,6-quinone Formula: C17H17N3O2 MolecularWeight: 295.33578

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Descriptors Computed from Structure

Canonical SMILES:

C1C(=O)N(CC(=O)NC2=CC=CC=C2N1)CC3=CC=CC=C3

Isomeric SMILES

C1C(=O)N(CC(=O)NC2=CC=CC=C2N1)CC3=CC=CC=C3

InChI

InChI=1S/C17H17N3O2/c21-16-12-20(11-13-6-2-1-3-7-13)17(22)10-18-14-8-4-5-9-15(14)19-16/h1-9,18H,10-12H2,(H,19,21)