6-(azepan-1-ylmethyl)-2-(6,6-diphenylhexyl)-3,4-dihydro-1H-isoquinolin-5-ol

Systemtic Name: 6-(azepan-1-ylmethyl)-2-(6,6-diphenylhexyl)-3,4-dihydro-1H-isoquinolin-5-ol Openeye Name: 6-(azepan-1-ylmethyl)-2-(6,6-diphenylhexyl)-3,4-dihydro-1H-isoquinolin-5-ol CAS Name: 6-(1-azepanylmethyl)-2-(6,6-diphenylhexyl)-3,4-dihydro-1H-isoquinolin-5-ol IUPAC Name: 6-(azepan-1-ylmethyl)-2-(6,6-diphenylhexyl)-3,4-dihydro-1H-isoquinolin-5-ol Traditional Name: 6-(azepan-1-ylmethyl)-2-(6,6-diphenylhexyl)-3,4-dihydro-1H-isoquinolin-5-ol Formula: C34H44N2O MolecularWeight: 496.72596

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)CC2=C(C3=C(CN(CC3)CCCCCC(C4=CC=CC=C4)C5=CC=CC=C5)C=C2)O

Isomeric SMILES

C1CCCN(CC1)CC2=C(C3=C(CN(CC3)CCCCCC(C4=CC=CC=C4)C5=CC=CC=C5)C=C2)O

InChI

InChI=1S/C34H44N2O/c37-34-31(27-35-22-11-1-2-12-23-35)20-19-30-26-36(25-21-33(30)34)24-13-5-10-18-32(28-14-6-3-7-15-28)29-16-8-4-9-17-29/h3-4,6-9,14-17,19-20,32,37H,1-2,5,10-13,18,21-27H2