N-(3-chlorophenyl)-2-oxidanylidene-3-pyridin-3-ylcarbonyl-3a,4,5,6,7,7a-hexahydro-1,3-benzoxazole-6-sulfonamide

Systemtic Name: N-(3-chlorophenyl)-2-oxidanylidene-3-pyridin-3-ylcarbonyl-3a,4,5,6,7,7a-hexahydro-1,3-benzoxazole-6-sulfonamide Openeye Name: N-(3-chlorophenyl)-2-oxo-3-(pyridine-3-carbonyl)-3a,4,5,6,7,7a-hexahydro-1,3-benzoxazole-6-sulfonamide CAS Name: N-(3-chlorophenyl)-2-oxo-3-[oxo(3-pyridinyl)methyl]-3a,4,5,6,7,7a-hexahydro-1,3-benzoxazole-6-sulfonamide IUPAC Name: N-(3-chlorophenyl)-2-oxo-3-(pyridine-3-carbonyl)-3a,4,5,6,7,7a-hexahydro-1,3-benzoxazole-6-sulfonamide Traditional Name: N-(3-chlorophenyl)-2-keto-3-nicotinoyl-3a,4,5,6,7,7a-hexahydro-1,3-benzoxazole-6-sulfonamide Formula: C19H18ClN3O5S MolecularWeight: 435.88132

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2C(CC1S(=O)(=O)NC3=CC(=CC=C3)Cl)OC(=O)N2C(=O)C4=CN=CC=C4

Isomeric SMILES

C1CC2C(CC1S(=O)(=O)NC3=CC(=CC=C3)Cl)OC(=O)N2C(=O)C4=CN=CC=C4

InChI

InChI=1S/C19H18ClN3O5S/c20-13-4-1-5-14(9-13)22-29(26,27)15-6-7-16-17(10-15)28-19(25)23(16)18(24)12-3-2-8-21-11-12/h1-5,8-9,11,15-17,22H,6-7,10H2