(3R)-N-cycloheptyl-2-ethylsulfonyl-3,4-dihydro-1H-isoquinoline-3-carboxamide

Systemtic Name: (3R)-N-cycloheptyl-2-ethylsulfonyl-3,4-dihydro-1H-isoquinoline-3-carboxamide Openeye Name: (3R)-N-cycloheptyl-2-ethylsulfonyl-3,4-dihydro-1H-isoquinoline-3-carboxamide CAS Name: (3R)-N-cycloheptyl-2-ethylsulfonyl-3,4-dihydro-1H-isoquinoline-3-carboxamide IUPAC Name: (3R)-N-cycloheptyl-2-ethylsulfonyl-3,4-dihydro-1H-isoquinoline-3-carboxamide Traditional Name: (3R)-N-cycloheptyl-2-esyl-3,4-dihydro-1H-isoquinoline-3-carboxamide Formula: C19H28N2O3S MolecularWeight: 364.50222

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCS(=O)(=O)N1CC2=CC=CC=C2CC1C(=O)NC3CCCCCC3

Isomeric SMILES

CCS(=O)(=O)N1CC2=CC=CC=C2C[C@@H]1C(=O)NC3CCCCCC3

InChI

InChI=1S/C19H28N2O3S/c1-2-25(23,24)21-14-16-10-8-7-9-15(16)13-18(21)19(22)20-17-11-5-3-4-6-12-17/h7-10,17-18H,2-6,11-14H2,1H3,(H,20,22)/t18-/m1/s1