1-(4-morpholin-4-ylcarbonylpiperidin-1-yl)-2-(4-nitrophenyl)sulfanyl-ethanone

Systemtic Name: 1-(4-morpholin-4-ylcarbonylpiperidin-1-yl)-2-(4-nitrophenyl)sulfanyl-ethanone Openeye Name: 1-[4-(morpholine-4-carbonyl)-1-piperidyl]-2-(4-nitrophenyl)sulfanyl-ethanone CAS Name: 1-[4-[4-morpholinyl(oxo)methyl]-1-piperidinyl]-2-[(4-nitrophenyl)thio]ethanone IUPAC Name: 1-[4-(morpholine-4-carbonyl)piperidin-1-yl]-2-(4-nitrophenyl)sulfanylethanone Traditional Name: 1-[4-(morpholine-4-carbonyl)piperidino]-2-[(4-nitrophenyl)thio]ethanone Formula: C18H23N3O5S MolecularWeight: 393.45732

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)N2CCOCC2)C(=O)CSC3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

C1CN(CCC1C(=O)N2CCOCC2)C(=O)CSC3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C18H23N3O5S/c22-17(13-27-16-3-1-15(2-4-16)21(24)25)19-7-5-14(6-8-19)18(23)20-9-11-26-12-10-20/h1-4,14H,5-13H2