N-cyclooctyl-2-ethylsulfonyl-3,4-dihydro-1H-isoquinoline-3-carboxamide

Systemtic Name: N-cyclooctyl-2-ethylsulfonyl-3,4-dihydro-1H-isoquinoline-3-carboxamide Openeye Name: N-cyclooctyl-2-ethylsulfonyl-3,4-dihydro-1H-isoquinoline-3-carboxamide CAS Name: N-cyclooctyl-2-ethylsulfonyl-3,4-dihydro-1H-isoquinoline-3-carboxamide IUPAC Name: N-cyclooctyl-2-ethylsulfonyl-3,4-dihydro-1H-isoquinoline-3-carboxamide Traditional Name: N-cyclooctyl-2-esyl-3,4-dihydro-1H-isoquinoline-3-carboxamide Formula: C20H30N2O3S MolecularWeight: 378.5288

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCS(=O)(=O)N1CC2=CC=CC=C2CC1C(=O)NC3CCCCCCC3

Isomeric SMILES

CCS(=O)(=O)N1CC2=CC=CC=C2CC1C(=O)NC3CCCCCCC3

InChI

InChI=1S/C20H30N2O3S/c1-2-26(24,25)22-15-17-11-9-8-10-16(17)14-19(22)20(23)21-18-12-6-4-3-5-7-13-18/h8-11,18-19H,2-7,12-15H2,1H3,(H,21,23)