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

Systemtic Name: N-tert-butyl-2-[3-(4-methoxyphenoxy)-2-oxidanyl-propyl]-3,4-dihydro-1H-isoquinoline-3-carboxamide Openeye Name: N-tert-butyl-2-[2-hydroxy-3-(4-methoxyphenoxy)propyl]-3,4-dihydro-1H-isoquinoline-3-carboxamide CAS Name: N-tert-butyl-2-[2-hydroxy-3-(4-methoxyphenoxy)propyl]-3,4-dihydro-1H-isoquinoline-3-carboxamide IUPAC Name: N-tert-butyl-2-[2-hydroxy-3-(4-methoxyphenoxy)propyl]-3,4-dihydro-1H-isoquinoline-3-carboxamide Traditional Name: N-tert-butyl-2-[2-hydroxy-3-(4-methoxyphenoxy)propyl]-3,4-dihydro-1H-isoquinoline-3-carboxamide Formula: C24H32N2O4 MolecularWeight: 412.52188

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C24H32N2O4/c1-24(2,3)25-23(28)22-13-17-7-5-6-8-18(17)14-26(22)15-19(27)16-30-21-11-9-20(29-4)10-12-21/h5-12,19,22,27H,13-16H2,1-4H3,(H,25,28)