5-[4-[4-(4-chloranyl-3-nitro-phenyl)-1,3-thiazol-2-yl]piperidin-1-yl]carbonyl-4,6-dimethyl-pyran-2-one

Systemtic Name: 5-[4-[4-(4-chloranyl-3-nitro-phenyl)-1,3-thiazol-2-yl]piperidin-1-yl]carbonyl-4,6-dimethyl-pyran-2-one Openeye Name: 5-[4-[4-(4-chloro-3-nitro-phenyl)thiazol-2-yl]piperidine-1-carbonyl]-4,6-dimethyl-pyran-2-one CAS Name: 5-[[4-[4-(4-chloro-3-nitrophenyl)-2-thiazolyl]-1-piperidinyl]-oxomethyl]-4,6-dimethyl-2-pyranone IUPAC Name: 5-[4-[4-(4-chloro-3-nitrophenyl)-1,3-thiazol-2-yl]piperidine-1-carbonyl]-4,6-dimethylpyran-2-one Traditional Name: 5-[4-[4-(4-chloro-3-nitro-phenyl)thiazol-2-yl]piperidine-1-carbonyl]-4,6-dimethyl-pyran-2-one Formula: C22H20ClN3O5S MolecularWeight: 473.9293

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=O)OC(=C1C(=O)N2CCC(CC2)C3=NC(=CS3)C4=CC(=C(C=C4)Cl)[N+](=O)[O-])C

Isomeric SMILES

CC1=CC(=O)OC(=C1C(=O)N2CCC(CC2)C3=NC(=CS3)C4=CC(=C(C=C4)Cl)[N+](=O)[O-])C

InChI

InChI=1S/C22H20ClN3O5S/c1-12-9-19(27)31-13(2)20(12)22(28)25-7-5-14(6-8-25)21-24-17(11-32-21)15-3-4-16(23)18(10-15)26(29)30/h3-4,9-11,14H,5-8H2,1-2H3