N-[azanyl(pyrrolidin-1-yl)methylidene]-3-nitro-benzamide

Systemtic Name: N-[azanyl(pyrrolidin-1-yl)methylidene]-3-nitro-benzamide Openeye Name: N-[amino(pyrrolidin-1-yl)methylene]-3-nitro-benzamide CAS Name: N-[amino(1-pyrrolidinyl)methylidene]-3-nitrobenzamide IUPAC Name: N-[amino(pyrrolidin-1-yl)methylidene]-3-nitrobenzamide Traditional Name: N-[amino(pyrrolidino)methylene]-3-nitro-benzamide Formula: C12H14N4O3 MolecularWeight: 262.26456

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C(=NC(=O)C2=CC(=CC=C2)[N+](=O)[O-])N

Isomeric SMILES

C1CCN(C1)C(=NC(=O)C2=CC(=CC=C2)[N+](=O)[O-])N

InChI

InChI=1S/C12H14N4O3/c13-12(15-6-1-2-7-15)14-11(17)9-4-3-5-10(8-9)16(18)19/h3-5,8H,1-2,6-7H2,(H2,13,14,17)