3-(2-chloranyl-4-nitro-phenyl)sulfanyl-1-pyrrolidin-1-yl-propan-1-one

Systemtic Name: 3-(2-chloranyl-4-nitro-phenyl)sulfanyl-1-pyrrolidin-1-yl-propan-1-one Openeye Name: 3-(2-chloro-4-nitro-phenyl)sulfanyl-1-pyrrolidin-1-yl-propan-1-one CAS Name: 3-[(2-chloro-4-nitrophenyl)thio]-1-(1-pyrrolidinyl)-1-propanone IUPAC Name: 3-(2-chloro-4-nitrophenyl)sulfanyl-1-pyrrolidin-1-ylpropan-1-one Traditional Name: 3-[(2-chloro-4-nitro-phenyl)thio]-1-pyrrolidino-propan-1-one Formula: C13H15ClN2O3S MolecularWeight: 314.7878

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C(=O)CCSC2=C(C=C(C=C2)[N+](=O)[O-])Cl

Isomeric SMILES

C1CCN(C1)C(=O)CCSC2=C(C=C(C=C2)[N+](=O)[O-])Cl

InChI

InChI=1S/C13H15ClN2O3S/c14-11-9-10(16(18)19)3-4-12(11)20-8-5-13(17)15-6-1-2-7-15/h3-4,9H,1-2,5-8H2