6,7-dimethoxy-3-[2-[(2S)-oxan-2-yl]oxyethyl]isoquinoline

Systemtic Name: 6,7-dimethoxy-3-[2-[(2S)-oxan-2-yl]oxyethyl]isoquinoline Openeye Name: 6,7-dimethoxy-3-[2-[(2S)-tetrahydropyran-2-yl]oxyethyl]isoquinoline CAS Name: 6,7-dimethoxy-3-[2-[[(2S)-2-oxanyl]oxy]ethyl]isoquinoline IUPAC Name: 6,7-dimethoxy-3-[2-[(2S)-oxan-2-yl]oxyethyl]isoquinoline Traditional Name: 6,7-dimethoxy-3-[2-[(2S)-tetrahydropyran-2-yl]oxyethyl]isoquinoline Formula: C18H23NO4 MolecularWeight: 317.37952

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C=NC(=CC2=C1)CCOC3CCCCO3)OC

Isomeric SMILES

COC1=C(C=C2C=NC(=CC2=C1)CCO[C@H]3CCCCO3)OC

InChI

InChI=1S/C18H23NO4/c1-20-16-10-13-9-15(19-12-14(13)11-17(16)21-2)6-8-23-18-5-3-4-7-22-18/h9-12,18H,3-8H2,1-2H3/t18-/m0/s1