[4-[(2-nitrophenoxy)methyl]thiophen-2-yl]-pyrrolidin-1-yl-methanone

Systemtic Name: [4-[(2-nitrophenoxy)methyl]thiophen-2-yl]-pyrrolidin-1-yl-methanone Openeye Name: [4-[(2-nitrophenoxy)methyl]-2-thienyl]-pyrrolidin-1-yl-methanone CAS Name: [4-[(2-nitrophenoxy)methyl]-2-thiophenyl]-(1-pyrrolidinyl)methanone IUPAC Name: [4-[(2-nitrophenoxy)methyl]thiophen-2-yl]-pyrrolidin-1-ylmethanone Traditional Name: [4-[(2-nitrophenoxy)methyl]-2-thienyl]-pyrrolidino-methanone Formula: C16H16N2O4S MolecularWeight: 332.37424

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C(=O)C2=CC(=CS2)COC3=CC=CC=C3[N+](=O)[O-]

Isomeric SMILES

C1CCN(C1)C(=O)C2=CC(=CS2)COC3=CC=CC=C3[N+](=O)[O-]

InChI

InChI=1S/C16H16N2O4S/c19-16(17-7-3-4-8-17)15-9-12(11-23-15)10-22-14-6-2-1-5-13(14)18(20)21/h1-2,5-6,9,11H,3-4,7-8,10H2