1-[5-chloranyl-4-(2,3-dihydro-1,4-oxathiin-6-ylcarbonylamino)-2-methoxy-phenyl]carbonylpiperidine-4-carboxamide

Systemtic Name: 1-[5-chloranyl-4-(2,3-dihydro-1,4-oxathiin-6-ylcarbonylamino)-2-methoxy-phenyl]carbonylpiperidine-4-carboxamide Openeye Name: 1-[5-chloro-4-(2,3-dihydro-1,4-oxathiine-6-carbonylamino)-2-methoxy-benzoyl]piperidine-4-carboxamide CAS Name: 1-[[5-chloro-4-[[2,3-dihydro-1,4-oxathiin-6-yl(oxo)methyl]amino]-2-methoxyphenyl]-oxomethyl]-4-piperidinecarboxamide IUPAC Name: 1-[5-chloro-4-(2,3-dihydro-1,4-oxathiine-6-carbonylamino)-2-methoxybenzoyl]piperidine-4-carboxamide Traditional Name: 1-[5-chloro-4-(2,3-dihydro-1,4-oxathiin-6-carbonylamino)-2-methoxy-benzoyl]isonipecotamide Formula: C19H22ClN3O5S MolecularWeight: 439.91308

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1C(=O)N2CCC(CC2)C(=O)N)Cl)NC(=O)C3=CSCCO3

Isomeric SMILES

COC1=CC(=C(C=C1C(=O)N2CCC(CC2)C(=O)N)Cl)NC(=O)C3=CSCCO3

InChI

InChI=1S/C19H22ClN3O5S/c1-27-15-9-14(22-18(25)16-10-29-7-6-28-16)13(20)8-12(15)19(26)23-4-2-11(3-5-23)17(21)24/h8-11H,2-7H2,1H3,(H2,21,24)(H,22,25)