2-[2-nitro-4-(phenylcarbonyl)phenyl]sulfanyl-1-pyrrolidin-1-yl-ethanone

Systemtic Name: 2-[2-nitro-4-(phenylcarbonyl)phenyl]sulfanyl-1-pyrrolidin-1-yl-ethanone Openeye Name: 2-(4-benzoyl-2-nitro-phenyl)sulfanyl-1-pyrrolidin-1-yl-ethanone CAS Name: 2-[(4-benzoyl-2-nitrophenyl)thio]-1-(1-pyrrolidinyl)ethanone IUPAC Name: 2-(4-benzoyl-2-nitrophenyl)sulfanyl-1-pyrrolidin-1-ylethanone Traditional Name: 2-[(4-benzoyl-2-nitro-phenyl)thio]-1-pyrrolidino-ethanone Formula: C19H18N2O4S MolecularWeight: 370.42222

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C(=O)CSC2=C(C=C(C=C2)C(=O)C3=CC=CC=C3)[N+](=O)[O-]

Isomeric SMILES

C1CCN(C1)C(=O)CSC2=C(C=C(C=C2)C(=O)C3=CC=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C19H18N2O4S/c22-18(20-10-4-5-11-20)13-26-17-9-8-15(12-16(17)21(24)25)19(23)14-6-2-1-3-7-14/h1-3,6-9,12H,4-5,10-11,13H2