2-ethylsulfonyl-N-methyl-N-(2-phenoxyethyl)-3,4-dihydro-1H-isoquinoline-3-carboxamide

Systemtic Name: 2-ethylsulfonyl-N-methyl-N-(2-phenoxyethyl)-3,4-dihydro-1H-isoquinoline-3-carboxamide Openeye Name: 2-ethylsulfonyl-N-methyl-N-(2-phenoxyethyl)-3,4-dihydro-1H-isoquinoline-3-carboxamide CAS Name: 2-ethylsulfonyl-N-methyl-N-(2-phenoxyethyl)-3,4-dihydro-1H-isoquinoline-3-carboxamide IUPAC Name: 2-ethylsulfonyl-N-methyl-N-(2-phenoxyethyl)-3,4-dihydro-1H-isoquinoline-3-carboxamide Traditional Name: 2-esyl-N-methyl-N-(2-phenoxyethyl)-3,4-dihydro-1H-isoquinoline-3-carboxamide Formula: C21H26N2O4S MolecularWeight: 402.50714

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCS(=O)(=O)N1CC2=CC=CC=C2CC1C(=O)N(C)CCOC3=CC=CC=C3

Isomeric SMILES

CCS(=O)(=O)N1CC2=CC=CC=C2CC1C(=O)N(C)CCOC3=CC=CC=C3

InChI

InChI=1S/C21H26N2O4S/c1-3-28(25,26)23-16-18-10-8-7-9-17(18)15-20(23)21(24)22(2)13-14-27-19-11-5-4-6-12-19/h4-12,20H,3,13-16H2,1-2H3