3-[[4-(6-nitropyridin-3-yl)piperazin-1-yl]methyl]-1,3-benzoxazol-2-one

Systemtic Name: 3-[[4-(6-nitropyridin-3-yl)piperazin-1-yl]methyl]-1,3-benzoxazol-2-one Openeye Name: 3-[[4-(6-nitro-3-pyridyl)piperazin-1-yl]methyl]-1,3-benzoxazol-2-one CAS Name: 3-[[4-(6-nitro-3-pyridinyl)-1-piperazinyl]methyl]-1,3-benzoxazol-2-one IUPAC Name: 3-[[4-(6-nitropyridin-3-yl)piperazin-1-yl]methyl]-1,3-benzoxazol-2-one Traditional Name: 3-[[4-(6-nitro-3-pyridyl)piperazino]methyl]-1,3-benzoxazol-2-one Formula: C17H17N5O4 MolecularWeight: 355.34798

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CN2C3=CC=CC=C3OC2=O)C4=CN=C(C=C4)[N+](=O)[O-]

Isomeric SMILES

C1CN(CCN1CN2C3=CC=CC=C3OC2=O)C4=CN=C(C=C4)[N+](=O)[O-]

InChI

InChI=1S/C17H17N5O4/c23-17-21(14-3-1-2-4-15(14)26-17)12-19-7-9-20(10-8-19)13-5-6-16(18-11-13)22(24)25/h1-6,11H,7-10,12H2