3-[[4-(4-nitrophenyl)piperazin-1-yl]methyl]-1,2,3-benzotriazin-4-one

Systemtic Name: 3-[[4-(4-nitrophenyl)piperazin-1-yl]methyl]-1,2,3-benzotriazin-4-one Openeye Name: 3-[[4-(4-nitrophenyl)piperazin-1-yl]methyl]-1,2,3-benzotriazin-4-one CAS Name: 3-[[4-(4-nitrophenyl)-1-piperazinyl]methyl]-1,2,3-benzotriazin-4-one IUPAC Name: 3-[[4-(4-nitrophenyl)piperazin-1-yl]methyl]-1,2,3-benzotriazin-4-one Traditional Name: 3-[[4-(4-nitrophenyl)piperazino]methyl]-1,2,3-benzotriazin-4-one Formula: C18H18N6O3 MolecularWeight: 366.37392

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CN2C(=O)C3=CC=CC=C3N=N2)C4=CC=C(C=C4)[N+](=O)[O-]

Isomeric SMILES

C1CN(CCN1CN2C(=O)C3=CC=CC=C3N=N2)C4=CC=C(C=C4)[N+](=O)[O-]

InChI

InChI=1S/C18H18N6O3/c25-18-16-3-1-2-4-17(16)19-20-23(18)13-21-9-11-22(12-10-21)14-5-7-15(8-6-14)24(26)27/h1-8H,9-13H2