3-[bis(benzotriazol-1-yl)methyl]-5-phenyl-1,2-oxazole

Systemtic Name: 3-[bis(benzotriazol-1-yl)methyl]-5-phenyl-1,2-oxazole Openeye Name: 3-[bis(benzotriazol-1-yl)methyl]-5-phenyl-isoxazole CAS Name: 3-[bis(1-benzotriazolyl)methyl]-5-phenylisoxazole IUPAC Name: 3-[bis(benzotriazol-1-yl)methyl]-5-phenyl-1,2-oxazole Traditional Name: 3-[bis(benzotriazol-1-yl)methyl]-5-phenyl-isoxazole Formula: C22H15N7O MolecularWeight: 393.4008

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=CC(=NO2)C(N3C4=CC=CC=C4N=N3)N5C6=CC=CC=C6N=N5

Isomeric SMILES

C1=CC=C(C=C1)C2=CC(=NO2)C(N3C4=CC=CC=C4N=N3)N5C6=CC=CC=C6N=N5

InChI

InChI=1S/C22H15N7O/c1-2-8-15(9-3-1)21-14-18(25-30-21)22(28-19-12-6-4-10-16(19)23-26-28)29-20-13-7-5-11-17(20)24-27-29/h1-14,22H