2-ethylsulfonyl-N-[4-(2-methoxyphenoxy)phenyl]-3,4-dihydro-1H-isoquinoline-3-carboxamide

Systemtic Name: 2-ethylsulfonyl-N-[4-(2-methoxyphenoxy)phenyl]-3,4-dihydro-1H-isoquinoline-3-carboxamide Openeye Name: 2-ethylsulfonyl-N-[4-(2-methoxyphenoxy)phenyl]-3,4-dihydro-1H-isoquinoline-3-carboxamide CAS Name: 2-ethylsulfonyl-N-[4-(2-methoxyphenoxy)phenyl]-3,4-dihydro-1H-isoquinoline-3-carboxamide IUPAC Name: 2-ethylsulfonyl-N-[4-(2-methoxyphenoxy)phenyl]-3,4-dihydro-1H-isoquinoline-3-carboxamide Traditional Name: 2-esyl-N-[4-(2-methoxyphenoxy)phenyl]-3,4-dihydro-1H-isoquinoline-3-carboxamide Formula: C25H26N2O5S MolecularWeight: 466.54934

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Descriptors Computed from Structure

Canonical SMILES:

CCS(=O)(=O)N1CC2=CC=CC=C2CC1C(=O)NC3=CC=C(C=C3)OC4=CC=CC=C4OC

Isomeric SMILES

CCS(=O)(=O)N1CC2=CC=CC=C2CC1C(=O)NC3=CC=C(C=C3)OC4=CC=CC=C4OC

InChI

InChI=1S/C25H26N2O5S/c1-3-33(29,30)27-17-19-9-5-4-8-18(19)16-22(27)25(28)26-20-12-14-21(15-13-20)32-24-11-7-6-10-23(24)31-2/h4-15,22H,3,16-17H2,1-2H3,(H,26,28)