N-methyl-N-[6-(methylamino)hexyl]-2-[2-(4-phenylmethoxyphenyl)ethanoyl]-3,4-dihydro-1H-isoquinoline-3-carboxamide

Systemtic Name: N-methyl-N-[6-(methylamino)hexyl]-2-[2-(4-phenylmethoxyphenyl)ethanoyl]-3,4-dihydro-1H-isoquinoline-3-carboxamide Openeye Name: 2-[2-(4-benzyloxyphenyl)acetyl]-N-methyl-N-[6-(methylamino)hexyl]-3,4-dihydro-1H-isoquinoline-3-carboxamide CAS Name: N-methyl-N-[6-(methylamino)hexyl]-2-[1-oxo-2-(4-phenylmethoxyphenyl)ethyl]-3,4-dihydro-1H-isoquinoline-3-carboxamide IUPAC Name: N-methyl-N-[6-(methylamino)hexyl]-2-[2-(4-phenylmethoxyphenyl)acetyl]-3,4-dihydro-1H-isoquinoline-3-carboxamide Traditional Name: 2-[2-(4-benzoxyphenyl)acetyl]-N-methyl-N-[6-(methylamino)hexyl]-3,4-dihydro-1H-isoquinoline-3-carboxamide Formula: C33H41N3O3 MolecularWeight: 527.69694

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Descriptors Computed from Structure

Canonical SMILES:

CNCCCCCCN(C)C(=O)C1CC2=CC=CC=C2CN1C(=O)CC3=CC=C(C=C3)OCC4=CC=CC=C4

Isomeric SMILES

CNCCCCCCN(C)C(=O)C1CC2=CC=CC=C2CN1C(=O)CC3=CC=C(C=C3)OCC4=CC=CC=C4

InChI

InChI=1S/C33H41N3O3/c1-34-20-10-3-4-11-21-35(2)33(38)31-23-28-14-8-9-15-29(28)24-36(31)32(37)22-26-16-18-30(19-17-26)39-25-27-12-6-5-7-13-27/h5-9,12-19,31,34H,3-4,10-11,20-25H2,1-2H3