1-[4-[2-(4-methanidyloxyphenyl)propan-2-yl]phenoxy]butan-2-ol; yttrium(3+)

Systemtic Name: 1-[4-[2-(4-methanidyloxyphenyl)propan-2-yl]phenoxy]butan-2-ol; yttrium(3+) Openeye Name: 1-[4-[1-(4-methanidyloxyphenyl)-1-methyl-ethyl]phenoxy]butan-2-ol; yttrium(3+) CAS Name: 1-[4-[2-(4-methanidyloxyphenyl)propan-2-yl]phenoxy]-2-butanol; yttrium(3+) IUPAC Name: 1-[4-[2-(4-methanidyloxyphenyl)propan-2-yl]phenoxy]butan-2-ol; yttrium(3+) Traditional Name: 1-[4-[1-(4-methanidyloxyphenyl)-1-methyl-ethyl]phenoxy]butan-2-ol; yttrium(3+) Formula: C20H25O3Y+2 MolecularWeight: 402.31655

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Descriptors Computed from Structure

Canonical SMILES:

CCC(COC1=CC=C(C=C1)C(C)(C)C2=CC=C(C=C2)O[CH2-])O.[Y+3]

Isomeric SMILES

CCC(COC1=CC=C(C=C1)C(C)(C)C2=CC=C(C=C2)O[CH2-])O.[Y+3]

InChI

InChI=1S/C20H25O3.Y/c1-5-17(21)14-23-19-12-8-16(9-13-19)20(2,3)15-6-10-18(22-4)11-7-15;/h6-13,17,21H,4-5,14H2,1-3H3;/q-1;+3