1-isoquinolin-5-ylsulfonylpiperidin-3-one

Systemtic Name: 1-isoquinolin-5-ylsulfonylpiperidin-3-one Openeye Name: 1-(5-isoquinolylsulfonyl)piperidin-3-one CAS Name: 1-(5-isoquinolinylsulfonyl)-3-piperidinone IUPAC Name: 1-isoquinolin-5-ylsulfonylpiperidin-3-one Traditional Name: 1-(5-isoquinolylsulfonyl)-3-piperidone Formula: C14H14N2O3S MolecularWeight: 290.33756

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC(=O)CN(C1)S(=O)(=O)C2=CC=CC3=C2C=CN=C3

Isomeric SMILES

C1CC(=O)CN(C1)S(=O)(=O)C2=CC=CC3=C2C=CN=C3

InChI

InChI=1S/C14H14N2O3S/c17-12-4-2-8-16(10-12)20(18,19)14-5-1-3-11-9-15-7-6-13(11)14/h1,3,5-7,9H,2,4,8,10H2