N-(3-chloranyl-4-methoxy-phenyl)-1-[(3-methyl-2-oxidanylidene-1,3-benzoxazol-6-yl)sulfonyl]piperidine-3-carboxamide

Systemtic Name: N-(3-chloranyl-4-methoxy-phenyl)-1-[(3-methyl-2-oxidanylidene-1,3-benzoxazol-6-yl)sulfonyl]piperidine-3-carboxamide Openeye Name: N-(3-chloro-4-methoxy-phenyl)-1-[(3-methyl-2-oxo-1,3-benzoxazol-6-yl)sulfonyl]piperidine-3-carboxamide CAS Name: N-(3-chloro-4-methoxyphenyl)-1-[(3-methyl-2-oxo-1,3-benzoxazol-6-yl)sulfonyl]-3-piperidinecarboxamide IUPAC Name: N-(3-chloro-4-methoxyphenyl)-1-[(3-methyl-2-oxo-1,3-benzoxazol-6-yl)sulfonyl]piperidine-3-carboxamide Traditional Name: N-(3-chloro-4-methoxy-phenyl)-1-[(2-keto-3-methyl-1,3-benzoxazol-6-yl)sulfonyl]nipecotamide Formula: C21H22ClN3O6S MolecularWeight: 479.93388

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C=C(C=C2)S(=O)(=O)N3CCCC(C3)C(=O)NC4=CC(=C(C=C4)OC)Cl)OC1=O

Isomeric SMILES

CN1C2=C(C=C(C=C2)S(=O)(=O)N3CCCC(C3)C(=O)NC4=CC(=C(C=C4)OC)Cl)OC1=O

InChI

InChI=1S/C21H22ClN3O6S/c1-24-17-7-6-15(11-19(17)31-21(24)27)32(28,29)25-9-3-4-13(12-25)20(26)23-14-5-8-18(30-2)16(22)10-14/h5-8,10-11,13H,3-4,9,12H2,1-2H3,(H,23,26)