3-oxidanylidenebutan-2-yl 4-(2-methylpiperidin-1-yl)sulfonylbenzoate

Systemtic Name: 3-oxidanylidenebutan-2-yl 4-(2-methylpiperidin-1-yl)sulfonylbenzoate Openeye Name: (1-methyl-2-oxo-propyl) 4-[(2-methyl-1-piperidyl)sulfonyl]benzoate CAS Name: 4-[(2-methyl-1-piperidinyl)sulfonyl]benzoic acid 3-oxobutan-2-yl ester IUPAC Name: 3-oxobutan-2-yl 4-(2-methylpiperidin-1-yl)sulfonylbenzoate Traditional Name: 4-(2-methylpiperidino)sulfonylbenzoic acid (2-keto-1-methyl-propyl) ester Formula: C17H23NO5S MolecularWeight: 353.43322

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1CCCCN1S(=O)(=O)C2=CC=C(C=C2)C(=O)OC(C)C(=O)C

Isomeric SMILES

CC1CCCCN1S(=O)(=O)C2=CC=C(C=C2)C(=O)OC(C)C(=O)C

InChI

InChI=1S/C17H23NO5S/c1-12-6-4-5-11-18(12)24(21,22)16-9-7-15(8-10-16)17(20)23-14(3)13(2)19/h7-10,12,14H,4-6,11H2,1-3H3