2-(2-methoxy-5-pyridin-4-yl-phenyl)-9-(phenylmethyl)-4-oxa-9-azaspiro[4.5]dec-1-ene dihydrochloride

Systemtic Name: 2-(2-methoxy-5-pyridin-4-yl-phenyl)-9-(phenylmethyl)-4-oxa-9-azaspiro[4.5]dec-1-ene dihydrochloride Openeye Name: 9-benzyl-2-[2-methoxy-5-(4-pyridyl)phenyl]-4-oxa-9-azaspiro[4.5]dec-1-ene dihydrochloride CAS Name: 2-(2-methoxy-5-pyridin-4-ylphenyl)-9-(phenylmethyl)-4-oxa-9-azaspiro[4.5]dec-1-ene dihydrochloride IUPAC Name: 9-benzyl-2-(2-methoxy-5-pyridin-4-ylphenyl)-4-oxa-9-azaspiro[4.5]dec-1-ene dihydrochloride Traditional Name: 9-benzyl-2-[2-methoxy-5-(4-pyridyl)phenyl]-4-oxa-9-azaspiro[4.5]dec-1-ene dihydrochloride Formula: C27H30Cl2N2O2 MolecularWeight: 485.4453

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2=CC=NC=C2)C3=CC4(CCCN(C4)CC5=CC=CC=C5)OC3.Cl.Cl

Isomeric SMILES

COC1=C(C=C(C=C1)C2=CC=NC=C2)C3=CC4(CCCN(C4)CC5=CC=CC=C5)OC3.Cl.Cl

InChI

InChI=1S/C27H28N2O2.2ClH/c1-30-26-9-8-23(22-10-13-28-14-11-22)16-25(26)24-17-27(31-19-24)12-5-15-29(20-27)18-21-6-3-2-4-7-21;;/h2-4,6-11,13-14,16-17H,5,12,15,18-20H2,1H3;2*1H