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2-[azanyl(benzotriazol-1-yl)methylidene]cyclohexane-1,3-dione; 2H-benzotriazole

2-[azanyl(benzotriazol-1-yl)methylidene]cyclohexane-1,3-dione; 2H-benzotriazole

Systemtic Name:2-[azanyl(benzotriazol-1-yl)methylidene]cyclohexane-1,3-dione; 2H-benzotriazole
Openeye Name:2-[amino(benzotriazol-1-yl)methylene]cyclohexane-1,3-dione; 2H-benzotriazole
CAS Name:2-[amino(1-benzotriazolyl)methylidene]cyclohexane-1,3-dione; 2H-benzotriazole
IUPAC Name:2-[amino(benzotriazol-1-yl)methylidene]cyclohexane-1,3-dione; 2H-benzotriazole
Traditional Name:2-[amino(benzotriazol-1-yl)methylene]cyclohexane-1,3-quinone; 2H-benzotriazole
Formula: C19H17N7O2
MolecularWeight: 375.38398
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Descriptors Computed from Structure

Canonical SMILES:

C1CC(=O)C(=C(N)N2C3=CC=CC=C3N=N2)C(=O)C1.C1=CC2=NNN=C2C=C1


Isomeric SMILES

C1CC(=O)C(=C(N)N2C3=CC=CC=C3N=N2)C(=O)C1.C1=CC2=NNN=C2C=C1


InChI

InChI=1S/C13H12N4O2.C6H5N3/c14-13(12-10(18)6-3-7-11(12)19)17-9-5-2-1-4-8(9)15-16-17;1-2-4-6-5(3-1)7-9-8-6/h1-2,4-5H,3,6-7,14H2;1-4H,(H,7,8,9)


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