iodanylmethane; 5,6,7-trimethoxy-1-[(4-methoxyphenyl)methyl]isoquinoline

Systemtic Name: iodanylmethane; 5,6,7-trimethoxy-1-[(4-methoxyphenyl)methyl]isoquinoline Openeye Name: iodomethane; 5,6,7-trimethoxy-1-[(4-methoxyphenyl)methyl]isoquinoline CAS Name: iodomethane; 5,6,7-trimethoxy-1-[(4-methoxyphenyl)methyl]isoquinoline IUPAC Name: iodomethane; 5,6,7-trimethoxy-1-[(4-methoxyphenyl)methyl]isoquinoline Traditional Name: iodomethane; 5,6,7-trimethoxy-1-p-anisyl-isoquinoline Formula: C21H24INO4 MolecularWeight: 481.32403

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CC2=NC=CC3=C(C(=C(C=C32)OC)OC)OC.CI

Isomeric SMILES

COC1=CC=C(C=C1)CC2=NC=CC3=C(C(=C(C=C32)OC)OC)OC.CI

InChI

InChI=1S/C20H21NO4.CH3I/c1-22-14-7-5-13(6-8-14)11-17-16-12-18(23-2)20(25-4)19(24-3)15(16)9-10-21-17;1-2/h5-10,12H,11H2,1-4H3;1H3