(7R)-6-hexylsulfonyl-7,8-dihydro-5H-pyrido[3,4-b]pyrazine-7-carboxylic acid

Systemtic Name: (7R)-6-hexylsulfonyl-7,8-dihydro-5H-pyrido[3,4-b]pyrazine-7-carboxylic acid Openeye Name: (7R)-6-hexylsulfonyl-7,8-dihydro-5H-pyrido[3,4-b]pyrazine-7-carboxylic acid CAS Name: (7R)-6-hexylsulfonyl-7,8-dihydro-5H-pyrido[3,4-b]pyrazine-7-carboxylic acid IUPAC Name: (7R)-6-hexylsulfonyl-7,8-dihydro-5H-pyrido[3,4-b]pyrazine-7-carboxylic acid Traditional Name: (7R)-6-hexylsulfonyl-7,8-dihydro-5H-pyrido[3,4-b]pyrazine-7-carboxylic acid Formula: C14H21N3O4S MolecularWeight: 327.39924

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCS(=O)(=O)N1CC2=NC=CN=C2CC1C(=O)O

Isomeric SMILES

CCCCCCS(=O)(=O)N1CC2=NC=CN=C2C[C@@H]1C(=O)O

InChI

InChI=1S/C14H21N3O4S/c1-2-3-4-5-8-22(20,21)17-10-12-11(15-6-7-16-12)9-13(17)14(18)19/h6-7,13H,2-5,8-10H2,1H3,(H,18,19)/t13-/m1/s1