3,4,5-trimethoxy-N-[2-[4-(6-nitropyridin-3-yl)piperazin-1-yl]-2-oxidanylidene-ethyl]benzamide

Systemtic Name: 3,4,5-trimethoxy-N-[2-[4-(6-nitropyridin-3-yl)piperazin-1-yl]-2-oxidanylidene-ethyl]benzamide Openeye Name: 3,4,5-trimethoxy-N-[2-[4-(6-nitro-3-pyridyl)piperazin-1-yl]-2-oxo-ethyl]benzamide CAS Name: 3,4,5-trimethoxy-N-[2-[4-(6-nitro-3-pyridinyl)-1-piperazinyl]-2-oxoethyl]benzamide IUPAC Name: 3,4,5-trimethoxy-N-[2-[4-(6-nitropyridin-3-yl)piperazin-1-yl]-2-oxoethyl]benzamide Traditional Name: N-[2-keto-2-[4-(6-nitro-3-pyridyl)piperazino]ethyl]-3,4,5-trimethoxy-benzamide Formula: C21H25N5O7 MolecularWeight: 459.4525

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OC)OC)C(=O)NCC(=O)N2CCN(CC2)C3=CN=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

COC1=CC(=CC(=C1OC)OC)C(=O)NCC(=O)N2CCN(CC2)C3=CN=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C21H25N5O7/c1-31-16-10-14(11-17(32-2)20(16)33-3)21(28)23-13-19(27)25-8-6-24(7-9-25)15-4-5-18(22-12-15)26(29)30/h4-5,10-12H,6-9,13H2,1-3H3,(H,23,28)