[4-(2-morpholin-4-ylethylsulfanyl)-3-nitro-phenyl]-pyrrolidin-1-yl-methanone

Systemtic Name: [4-(2-morpholin-4-ylethylsulfanyl)-3-nitro-phenyl]-pyrrolidin-1-yl-methanone Openeye Name: [4-(2-morpholinoethylsulfanyl)-3-nitro-phenyl]-pyrrolidin-1-yl-methanone CAS Name: [4-[2-(4-morpholinyl)ethylthio]-3-nitrophenyl]-(1-pyrrolidinyl)methanone IUPAC Name: [4-(2-morpholin-4-ylethylsulfanyl)-3-nitrophenyl]-pyrrolidin-1-ylmethanone Traditional Name: [4-(2-morpholinoethylthio)-3-nitro-phenyl]-pyrrolidino-methanone Formula: C17H23N3O4S MolecularWeight: 365.44722

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C(=O)C2=CC(=C(C=C2)SCCN3CCOCC3)[N+](=O)[O-]

Isomeric SMILES

C1CCN(C1)C(=O)C2=CC(=C(C=C2)SCCN3CCOCC3)[N+](=O)[O-]

InChI

InChI=1S/C17H23N3O4S/c21-17(19-5-1-2-6-19)14-3-4-16(15(13-14)20(22)23)25-12-9-18-7-10-24-11-8-18/h3-4,13H,1-2,5-12H2