N-ethoxy-3-nitro-4-pyrrolidin-1-yl-benzamide

Systemtic Name: N-ethoxy-3-nitro-4-pyrrolidin-1-yl-benzamide Openeye Name: N-ethoxy-3-nitro-4-pyrrolidin-1-yl-benzamide CAS Name: N-ethoxy-3-nitro-4-(1-pyrrolidinyl)benzamide IUPAC Name: N-ethoxy-3-nitro-4-pyrrolidin-1-ylbenzamide Traditional Name: N-ethoxy-3-nitro-4-pyrrolidino-benzamide Formula: C13H17N3O4 MolecularWeight: 279.29178

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Descriptors Computed from Structure

Canonical SMILES:

CCONC(=O)C1=CC(=C(C=C1)N2CCCC2)[N+](=O)[O-]

Isomeric SMILES

CCONC(=O)C1=CC(=C(C=C1)N2CCCC2)[N+](=O)[O-]

InChI

InChI=1S/C13H17N3O4/c1-2-20-14-13(17)10-5-6-11(12(9-10)16(18)19)15-7-3-4-8-15/h5-6,9H,2-4,7-8H2,1H3,(H,14,17)