2-chloranyl-N-(2-methyl-3-oxidanylidene-4H-1,4-benzoxazin-6-yl)-5-piperidin-1-ylsulfonyl-benzamide

Systemtic Name: 2-chloranyl-N-(2-methyl-3-oxidanylidene-4H-1,4-benzoxazin-6-yl)-5-piperidin-1-ylsulfonyl-benzamide Openeye Name: 2-chloro-N-(2-methyl-3-oxo-4H-1,4-benzoxazin-6-yl)-5-(1-piperidylsulfonyl)benzamide CAS Name: 2-chloro-N-(2-methyl-3-oxo-4H-1,4-benzoxazin-6-yl)-5-(1-piperidinylsulfonyl)benzamide IUPAC Name: 2-chloro-N-(2-methyl-3-oxo-4H-1,4-benzoxazin-6-yl)-5-piperidin-1-ylsulfonylbenzamide Traditional Name: 2-chloro-N-(3-keto-2-methyl-4H-1,4-benzoxazin-6-yl)-5-piperidinosulfonyl-benzamide Formula: C21H22ClN3O5S MolecularWeight: 463.93448

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Descriptors Computed from Structure

Canonical SMILES:

CC1C(=O)NC2=C(O1)C=CC(=C2)NC(=O)C3=C(C=CC(=C3)S(=O)(=O)N4CCCCC4)Cl

Isomeric SMILES

CC1C(=O)NC2=C(O1)C=CC(=C2)NC(=O)C3=C(C=CC(=C3)S(=O)(=O)N4CCCCC4)Cl

InChI

InChI=1S/C21H22ClN3O5S/c1-13-20(26)24-18-11-14(5-8-19(18)30-13)23-21(27)16-12-15(6-7-17(16)22)31(28,29)25-9-3-2-4-10-25/h5-8,11-13H,2-4,9-10H2,1H3,(H,23,27)(H,24,26)