N-[[(3R)-1-(2,3-dihydro-1H-inden-2-yl)piperidin-3-yl]methyl]-N-(isoquinolin-5-ylmethyl)-2-methoxy-ethanamine

Systemtic Name: N-[[(3R)-1-(2,3-dihydro-1H-inden-2-yl)piperidin-3-yl]methyl]-N-(isoquinolin-5-ylmethyl)-2-methoxy-ethanamine Openeye Name: N-[[(3R)-1-indan-2-yl-3-piperidyl]methyl]-N-(5-isoquinolylmethyl)-2-methoxy-ethanamine CAS Name: N-[[(3R)-1-(2,3-dihydro-1H-inden-2-yl)-3-piperidinyl]methyl]-N-(5-isoquinolinylmethyl)-2-methoxyethanamine IUPAC Name: N-[[(3R)-1-(2,3-dihydro-1H-inden-2-yl)piperidin-3-yl]methyl]-N-(isoquinolin-5-ylmethyl)-2-methoxyethanamine Traditional Name: [(3R)-1-indan-2-yl-3-piperidyl]methyl-(5-isoquinolylmethyl)-(2-methoxyethyl)amine Formula: C28H35N3O MolecularWeight: 429.597

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COCCN(CC1CCCN(C1)C2CC3=CC=CC=C3C2)CC4=CC=CC5=C4C=CN=C5

Isomeric SMILES

COCCN(C[C@H]1CCCN(C1)C2CC3=CC=CC=C3C2)CC4=CC=CC5=C4C=CN=C5

InChI

InChI=1S/C28H35N3O/c1-32-15-14-30(21-26-10-4-9-25-18-29-12-11-28(25)26)19-22-6-5-13-31(20-22)27-16-23-7-2-3-8-24(23)17-27/h2-4,7-12,18,22,27H,5-6,13-17,19-21H2,1H3/t22-/m1/s1