2-(4-nitrophenoxy)-N-pyrrolidin-1-ylcarbothioyl-ethanamide

Systemtic Name: 2-(4-nitrophenoxy)-N-pyrrolidin-1-ylcarbothioyl-ethanamide Openeye Name: 2-(4-nitrophenoxy)-N-(pyrrolidine-1-carbothioyl)acetamide CAS Name: 2-(4-nitrophenoxy)-N-[1-pyrrolidinyl(sulfanylidene)methyl]acetamide IUPAC Name: 2-(4-nitrophenoxy)-N-(pyrrolidine-1-carbothioyl)acetamide Traditional Name: 2-(4-nitrophenoxy)-N-(pyrrolidine-1-carbothioyl)acetamide Formula: C13H15N3O4S MolecularWeight: 309.3409

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C(=S)NC(=O)COC2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

C1CCN(C1)C(=S)NC(=O)COC2=CC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C13H15N3O4S/c17-12(14-13(21)15-7-1-2-8-15)9-20-11-5-3-10(4-6-11)16(18)19/h3-6H,1-2,7-9H2,(H,14,17,21)