N-tert-butyl-2-(2-oxidanyl-3-phenoxy-propyl)-3,4-dihydro-1H-isoquinoline-3-carboxamide

Systemtic Name: N-tert-butyl-2-(2-oxidanyl-3-phenoxy-propyl)-3,4-dihydro-1H-isoquinoline-3-carboxamide Openeye Name: N-tert-butyl-2-(2-hydroxy-3-phenoxy-propyl)-3,4-dihydro-1H-isoquinoline-3-carboxamide CAS Name: N-tert-butyl-2-(2-hydroxy-3-phenoxypropyl)-3,4-dihydro-1H-isoquinoline-3-carboxamide IUPAC Name: N-tert-butyl-2-(2-hydroxy-3-phenoxypropyl)-3,4-dihydro-1H-isoquinoline-3-carboxamide Traditional Name: N-tert-butyl-2-(2-hydroxy-3-phenoxy-propyl)-3,4-dihydro-1H-isoquinoline-3-carboxamide Formula: C23H30N2O3 MolecularWeight: 382.4959

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)NC(=O)C1CC2=CC=CC=C2CN1CC(COC3=CC=CC=C3)O

Isomeric SMILES

CC(C)(C)NC(=O)C1CC2=CC=CC=C2CN1CC(COC3=CC=CC=C3)O

InChI

InChI=1S/C23H30N2O3/c1-23(2,3)24-22(27)21-13-17-9-7-8-10-18(17)14-25(21)15-19(26)16-28-20-11-5-4-6-12-20/h4-12,19,21,26H,13-16H2,1-3H3,(H,24,27)