N-(6-methoxypyridin-3-yl)-5-nitro-2-pyrrolidin-1-yl-benzamide

Systemtic Name: N-(6-methoxypyridin-3-yl)-5-nitro-2-pyrrolidin-1-yl-benzamide Openeye Name: N-(6-methoxy-3-pyridyl)-5-nitro-2-pyrrolidin-1-yl-benzamide CAS Name: N-(6-methoxy-3-pyridinyl)-5-nitro-2-(1-pyrrolidinyl)benzamide IUPAC Name: N-(6-methoxypyridin-3-yl)-5-nitro-2-pyrrolidin-1-ylbenzamide Traditional Name: N-(6-methoxy-3-pyridyl)-5-nitro-2-pyrrolidino-benzamide Formula: C17H18N4O4 MolecularWeight: 342.34922

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Descriptors Computed from Structure

Canonical SMILES:

COC1=NC=C(C=C1)NC(=O)C2=C(C=CC(=C2)[N+](=O)[O-])N3CCCC3

Isomeric SMILES

COC1=NC=C(C=C1)NC(=O)C2=C(C=CC(=C2)[N+](=O)[O-])N3CCCC3

InChI

InChI=1S/C17H18N4O4/c1-25-16-7-4-12(11-18-16)19-17(22)14-10-13(21(23)24)5-6-15(14)20-8-2-3-9-20/h4-7,10-11H,2-3,8-9H2,1H3,(H,19,22)