3,4,5-trimethoxy-2-nitro-N-[6-(3-oxidanylidenepiperazin-1-yl)pyridin-3-yl]benzamide

Systemtic Name: 3,4,5-trimethoxy-2-nitro-N-[6-(3-oxidanylidenepiperazin-1-yl)pyridin-3-yl]benzamide Openeye Name: 3,4,5-trimethoxy-2-nitro-N-[6-(3-oxopiperazin-1-yl)-3-pyridyl]benzamide CAS Name: 3,4,5-trimethoxy-2-nitro-N-[6-(3-oxo-1-piperazinyl)-3-pyridinyl]benzamide IUPAC Name: 3,4,5-trimethoxy-2-nitro-N-[6-(3-oxopiperazin-1-yl)pyridin-3-yl]benzamide Traditional Name: N-[6-(3-ketopiperazino)-3-pyridyl]-3,4,5-trimethoxy-2-nitro-benzamide Formula: C19H21N5O7 MolecularWeight: 431.39934

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=C(C(=C1)C(=O)NC2=CN=C(C=C2)N3CCNC(=O)C3)[N+](=O)[O-])OC)OC

Isomeric SMILES

COC1=C(C(=C(C(=C1)C(=O)NC2=CN=C(C=C2)N3CCNC(=O)C3)[N+](=O)[O-])OC)OC

InChI

InChI=1S/C19H21N5O7/c1-29-13-8-12(16(24(27)28)18(31-3)17(13)30-2)19(26)22-11-4-5-14(21-9-11)23-7-6-20-15(25)10-23/h4-5,8-9H,6-7,10H2,1-3H3,(H,20,25)(H,22,26)