3-nitro-N-(2-pyrrolidin-1-yl-2-thiophen-3-yl-ethyl)benzamide

Systemtic Name: 3-nitro-N-(2-pyrrolidin-1-yl-2-thiophen-3-yl-ethyl)benzamide Openeye Name: 3-nitro-N-[2-pyrrolidin-1-yl-2-(3-thienyl)ethyl]benzamide CAS Name: 3-nitro-N-[2-(1-pyrrolidinyl)-2-(3-thiophenyl)ethyl]benzamide IUPAC Name: 3-nitro-N-(2-pyrrolidin-1-yl-2-thiophen-3-ylethyl)benzamide Traditional Name: 3-nitro-N-[2-pyrrolidino-2-(3-thienyl)ethyl]benzamide Formula: C17H19N3O3S MolecularWeight: 345.41606

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C(CNC(=O)C2=CC(=CC=C2)[N+](=O)[O-])C3=CSC=C3

Isomeric SMILES

C1CCN(C1)C(CNC(=O)C2=CC(=CC=C2)[N+](=O)[O-])C3=CSC=C3

InChI

InChI=1S/C17H19N3O3S/c21-17(13-4-3-5-15(10-13)20(22)23)18-11-16(14-6-9-24-12-14)19-7-1-2-8-19/h3-6,9-10,12,16H,1-2,7-8,11H2,(H,18,21)