3,4,5-trimethoxy-2-nitro-N-(3-piperidin-1-ylpropyl)benzamide

Systemtic Name: 3,4,5-trimethoxy-2-nitro-N-(3-piperidin-1-ylpropyl)benzamide Openeye Name: 3,4,5-trimethoxy-2-nitro-N-[3-(1-piperidyl)propyl]benzamide CAS Name: 3,4,5-trimethoxy-2-nitro-N-[3-(1-piperidinyl)propyl]benzamide IUPAC Name: 3,4,5-trimethoxy-2-nitro-N-(3-piperidin-1-ylpropyl)benzamide Traditional Name: 3,4,5-trimethoxy-2-nitro-N-(3-piperidinopropyl)benzamide Formula: C18H27N3O6 MolecularWeight: 381.42348

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=C(C(=C1)C(=O)NCCCN2CCCCC2)[N+](=O)[O-])OC)OC

Isomeric SMILES

COC1=C(C(=C(C(=C1)C(=O)NCCCN2CCCCC2)[N+](=O)[O-])OC)OC

InChI

InChI=1S/C18H27N3O6/c1-25-14-12-13(15(21(23)24)17(27-3)16(14)26-2)18(22)19-8-7-11-20-9-5-4-6-10-20/h12H,4-11H2,1-3H3,(H,19,22)