tert-butyl 4-(6-methylsulfonyl-4-oxidanylidene-3,1-benzoxazin-2-yl)piperidine-1-carboxylate

Systemtic Name: tert-butyl 4-(6-methylsulfonyl-4-oxidanylidene-3,1-benzoxazin-2-yl)piperidine-1-carboxylate Openeye Name: tert-butyl 4-(6-methylsulfonyl-4-oxo-3,1-benzoxazin-2-yl)piperidine-1-carboxylate CAS Name: 4-(6-methylsulfonyl-4-oxo-3,1-benzoxazin-2-yl)-1-piperidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-(6-methylsulfonyl-4-oxo-3,1-benzoxazin-2-yl)piperidine-1-carboxylate Traditional Name: 4-(4-keto-6-mesyl-3,1-benzoxazin-2-yl)piperidine-1-carboxylic acid tert-butyl ester Formula: C19H24N2O6S MolecularWeight: 408.46866

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCC(CC1)C2=NC3=C(C=C(C=C3)S(=O)(=O)C)C(=O)O2

Isomeric SMILES

CC(C)(C)OC(=O)N1CCC(CC1)C2=NC3=C(C=C(C=C3)S(=O)(=O)C)C(=O)O2

InChI

InChI=1S/C19H24N2O6S/c1-19(2,3)27-18(23)21-9-7-12(8-10-21)16-20-15-6-5-13(28(4,24)25)11-14(15)17(22)26-16/h5-6,11-12H,7-10H2,1-4H3