(5-nitro-1-benzothiophen-2-yl)-pyrrolidin-1-yl-methanone

Systemtic Name: (5-nitro-1-benzothiophen-2-yl)-pyrrolidin-1-yl-methanone Openeye Name: (5-nitrobenzothiophen-2-yl)-pyrrolidin-1-yl-methanone CAS Name: (5-nitro-1-benzothiophen-2-yl)-(1-pyrrolidinyl)methanone IUPAC Name: (5-nitro-1-benzothiophen-2-yl)-pyrrolidin-1-ylmethanone Traditional Name: (5-nitrobenzothiophen-2-yl)-pyrrolidino-methanone Formula: C13H12N2O3S MolecularWeight: 276.31098

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C(=O)C2=CC3=C(S2)C=CC(=C3)[N+](=O)[O-]

Isomeric SMILES

C1CCN(C1)C(=O)C2=CC3=C(S2)C=CC(=C3)[N+](=O)[O-]

InChI

InChI=1S/C13H12N2O3S/c16-13(14-5-1-2-6-14)12-8-9-7-10(15(17)18)3-4-11(9)19-12/h3-4,7-8H,1-2,5-6H2