1-(3-nitro-4-propoxy-phenyl)sulfonylpyrrolidine

Systemtic Name: 1-(3-nitro-4-propoxy-phenyl)sulfonylpyrrolidine Openeye Name: 1-(3-nitro-4-propoxy-phenyl)sulfonylpyrrolidine CAS Name: 1-(3-nitro-4-propoxyphenyl)sulfonylpyrrolidine IUPAC Name: 1-(3-nitro-4-propoxyphenyl)sulfonylpyrrolidine Traditional Name: 1-(3-nitro-4-propoxy-phenyl)sulfonylpyrrolidine Formula: C13H18N2O5S MolecularWeight: 314.35742

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=C(C=C(C=C1)S(=O)(=O)N2CCCC2)[N+](=O)[O-]

Isomeric SMILES

CCCOC1=C(C=C(C=C1)S(=O)(=O)N2CCCC2)[N+](=O)[O-]

InChI

InChI=1S/C13H18N2O5S/c1-2-9-20-13-6-5-11(10-12(13)15(16)17)21(18,19)14-7-3-4-8-14/h5-6,10H,2-4,7-9H2,1H3