3-methyl-3-phenyl-5,6-diazabicyclo[5.3.1]undeca-1(11),7-diene-2,4-dione

Systemtic Name: 3-methyl-3-phenyl-5,6-diazabicyclo[5.3.1]undeca-1(11),7-diene-2,4-dione Openeye Name: 3-methyl-3-phenyl-5,6-diazabicyclo[5.3.1]undeca-1(11),7-diene-2,4-dione CAS Name: 3-methyl-3-phenyl-5,6-diazabicyclo[5.3.1]undeca-1(11),7-diene-2,4-dione IUPAC Name: 3-methyl-3-phenyl-5,6-diazabicyclo[5.3.1]undeca-1(11),7-diene-2,4-dione Traditional Name: 3-methyl-3-phenyl-5,6-diazabicyclo[5.3.1]undeca-1(11),7-diene-2,4-quinone Formula: C16H16N2O2 MolecularWeight: 268.31044

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C(=O)C2=CC(=CCC2)NNC1=O)C3=CC=CC=C3

Isomeric SMILES

CC1(C(=O)C2=CC(=CCC2)NNC1=O)C3=CC=CC=C3

InChI

InChI=1S/C16H16N2O2/c1-16(12-7-3-2-4-8-12)14(19)11-6-5-9-13(10-11)17-18-15(16)20/h2-4,7-10,17H,5-6H2,1H3,(H,18,20)