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

Systemtic Name: N-(3-cyanophenyl)-5-nitro-2-pyrrolidin-1-yl-benzamide Openeye Name: N-(3-cyanophenyl)-5-nitro-2-pyrrolidin-1-yl-benzamide CAS Name: N-(3-cyanophenyl)-5-nitro-2-(1-pyrrolidinyl)benzamide IUPAC Name: N-(3-cyanophenyl)-5-nitro-2-pyrrolidin-1-ylbenzamide Traditional Name: N-(3-cyanophenyl)-5-nitro-2-pyrrolidino-benzamide Formula: C18H16N4O3 MolecularWeight: 336.34464

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C2=C(C=C(C=C2)[N+](=O)[O-])C(=O)NC3=CC=CC(=C3)C#N

Isomeric SMILES

C1CCN(C1)C2=C(C=C(C=C2)[N+](=O)[O-])C(=O)NC3=CC=CC(=C3)C#N

InChI

InChI=1S/C18H16N4O3/c19-12-13-4-3-5-14(10-13)20-18(23)16-11-15(22(24)25)6-7-17(16)21-8-1-2-9-21/h3-7,10-11H,1-2,8-9H2,(H,20,23)