1-[3,5-di(propan-2-yloxy)phenyl]-3-ethoxy-3-ethyl-7-methoxy-4H-isoquinoline

Systemtic Name: 1-[3,5-di(propan-2-yloxy)phenyl]-3-ethoxy-3-ethyl-7-methoxy-4H-isoquinoline Openeye Name: 1-(3,5-diisopropoxyphenyl)-3-ethoxy-3-ethyl-7-methoxy-4H-isoquinoline CAS Name: 1-[3,5-di(propan-2-yloxy)phenyl]-3-ethoxy-3-ethyl-7-methoxy-4H-isoquinoline IUPAC Name: 1-[3,5-di(propan-2-yloxy)phenyl]-3-ethoxy-3-ethyl-7-methoxy-4H-isoquinoline Traditional Name: 1-(3,5-diisopropoxyphenyl)-3-ethoxy-3-ethyl-7-methoxy-4H-isoquinoline Formula: C26H35NO4 MolecularWeight: 425.5604

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Descriptors Computed from Structure

Canonical SMILES:

CCC1(CC2=C(C=C(C=C2)OC)C(=N1)C3=CC(=CC(=C3)OC(C)C)OC(C)C)OCC

Isomeric SMILES

CCC1(CC2=C(C=C(C=C2)OC)C(=N1)C3=CC(=CC(=C3)OC(C)C)OC(C)C)OCC

InChI

InChI=1S/C26H35NO4/c1-8-26(29-9-2)16-19-10-11-21(28-7)15-24(19)25(27-26)20-12-22(30-17(3)4)14-23(13-20)31-18(5)6/h10-15,17-18H,8-9,16H2,1-7H3