[1-[2-(4-chlorophenyl)sulfanyl-5-nitro-phenyl]carbonylpiperidin-4-yl]-morpholin-4-yl-methanone

Systemtic Name: [1-[2-(4-chlorophenyl)sulfanyl-5-nitro-phenyl]carbonylpiperidin-4-yl]-morpholin-4-yl-methanone Openeye Name: [1-[2-(4-chlorophenyl)sulfanyl-5-nitro-benzoyl]-4-piperidyl]-morpholino-methanone CAS Name: [1-[[2-[(4-chlorophenyl)thio]-5-nitrophenyl]-oxomethyl]-4-piperidinyl]-(4-morpholinyl)methanone IUPAC Name: [1-[2-(4-chlorophenyl)sulfanyl-5-nitrobenzoyl]piperidin-4-yl]-morpholin-4-ylmethanone Traditional Name: [1-[2-[(4-chlorophenyl)thio]-5-nitro-benzoyl]-4-piperidyl]-morpholino-methanone Formula: C23H24ClN3O5S MolecularWeight: 489.97176

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)N2CCOCC2)C(=O)C3=C(C=CC(=C3)[N+](=O)[O-])SC4=CC=C(C=C4)Cl

Isomeric SMILES

C1CN(CCC1C(=O)N2CCOCC2)C(=O)C3=C(C=CC(=C3)[N+](=O)[O-])SC4=CC=C(C=C4)Cl

InChI

InChI=1S/C23H24ClN3O5S/c24-17-1-4-19(5-2-17)33-21-6-3-18(27(30)31)15-20(21)23(29)25-9-7-16(8-10-25)22(28)26-11-13-32-14-12-26/h1-6,15-16H,7-14H2