N-tert-butyl-7-[4-[1-(tert-butylcarbamoyl)naphthalen-2-yl]-2-oxidanyl-butyl]-2-ethanoyl-N-methyl-3,4-dihydro-1H-isoquinoline-8-carboxamide

Systemtic Name: N-tert-butyl-7-[4-[1-(tert-butylcarbamoyl)naphthalen-2-yl]-2-oxidanyl-butyl]-2-ethanoyl-N-methyl-3,4-dihydro-1H-isoquinoline-8-carboxamide Openeye Name: 2-acetyl-N-tert-butyl-7-[4-[1-(tert-butylcarbamoyl)-2-naphthyl]-2-hydroxy-butyl]-N-methyl-3,4-dihydro-1H-isoquinoline-8-carboxamide CAS Name: 2-acetyl-N-tert-butyl-7-[4-[1-[(tert-butylamino)-oxomethyl]-2-naphthalenyl]-2-hydroxybutyl]-N-methyl-3,4-dihydro-1H-isoquinoline-8-carboxamide IUPAC Name: 2-acetyl-N-tert-butyl-7-[4-[1-(tert-butylcarbamoyl)naphthalen-2-yl]-2-hydroxybutyl]-N-methyl-3,4-dihydro-1H-isoquinoline-8-carboxamide Traditional Name: 2-acetyl-N-tert-butyl-7-[4-[1-(tert-butylcarbamoyl)-2-naphthyl]-2-hydroxy-butyl]-N-methyl-3,4-dihydro-1H-isoquinoline-8-carboxamide Formula: C36H47N3O4 MolecularWeight: 585.77608

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1CCC2=C(C1)C(=C(C=C2)CC(CCC3=C(C4=CC=CC=C4C=C3)C(=O)NC(C)(C)C)O)C(=O)N(C)C(C)(C)C

Isomeric SMILES

CC(=O)N1CCC2=C(C1)C(=C(C=C2)CC(CCC3=C(C4=CC=CC=C4C=C3)C(=O)NC(C)(C)C)O)C(=O)N(C)C(C)(C)C

InChI

InChI=1S/C36H47N3O4/c1-23(40)39-20-19-25-14-16-27(32(30(25)22-39)34(43)38(8)36(5,6)7)21-28(41)18-17-26-15-13-24-11-9-10-12-29(24)31(26)33(42)37-35(2,3)4/h9-16,28,41H,17-22H2,1-8H3,(H,37,42)