6-chloranyl-N-methyl-3-oxidanylidene-N-[2-oxidanylidene-2-[4-(phenylmethyl)piperidin-1-yl]ethyl]-4H-1,4-benzoxazine-7-sulfonamide

Systemtic Name: 6-chloranyl-N-methyl-3-oxidanylidene-N-[2-oxidanylidene-2-[4-(phenylmethyl)piperidin-1-yl]ethyl]-4H-1,4-benzoxazine-7-sulfonamide Openeye Name: N-[2-(4-benzyl-1-piperidyl)-2-oxo-ethyl]-6-chloro-N-methyl-3-oxo-4H-1,4-benzoxazine-7-sulfonamide CAS Name: 6-chloro-N-methyl-3-oxo-N-[2-oxo-2-[4-(phenylmethyl)-1-piperidinyl]ethyl]-4H-1,4-benzoxazine-7-sulfonamide IUPAC Name: N-[2-(4-benzylpiperidin-1-yl)-2-oxoethyl]-6-chloro-N-methyl-3-oxo-4H-1,4-benzoxazine-7-sulfonamide Traditional Name: N-[2-(4-benzylpiperidino)-2-keto-ethyl]-6-chloro-3-keto-N-methyl-4H-1,4-benzoxazine-7-sulfonamide Formula: C23H26ClN3O5S MolecularWeight: 491.98764

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC(=O)N1CCC(CC1)CC2=CC=CC=C2)S(=O)(=O)C3=C(C=C4C(=C3)OCC(=O)N4)Cl

Isomeric SMILES

CN(CC(=O)N1CCC(CC1)CC2=CC=CC=C2)S(=O)(=O)C3=C(C=C4C(=C3)OCC(=O)N4)Cl

InChI

InChI=1S/C23H26ClN3O5S/c1-26(33(30,31)21-13-20-19(12-18(21)24)25-22(28)15-32-20)14-23(29)27-9-7-17(8-10-27)11-16-5-3-2-4-6-16/h2-6,12-13,17H,7-11,14-15H2,1H3,(H,25,28)