1-[2-(3,4-dimethoxyphenyl)ethylamino]-3-[4-(1H-imidazol-2-ylmethoxymethyl)phenoxy]propan-2-ol

Systemtic Name: 1-[2-(3,4-dimethoxyphenyl)ethylamino]-3-[4-(1H-imidazol-2-ylmethoxymethyl)phenoxy]propan-2-ol Openeye Name: 1-[2-(3,4-dimethoxyphenyl)ethylamino]-3-[4-(1H-imidazol-2-ylmethoxymethyl)phenoxy]propan-2-ol CAS Name: 1-[2-(3,4-dimethoxyphenyl)ethylamino]-3-[4-(1H-imidazol-2-ylmethoxymethyl)phenoxy]-2-propanol IUPAC Name: 1-[2-(3,4-dimethoxyphenyl)ethylamino]-3-[4-(1H-imidazol-2-ylmethoxymethyl)phenoxy]propan-2-ol Traditional Name: 1-(homoveratrylamino)-3-[4-(1H-imidazol-2-ylmethoxymethyl)phenoxy]propan-2-ol Formula: C24H31N3O5 MolecularWeight: 441.52004

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CCNCC(COC2=CC=C(C=C2)COCC3=NC=CN3)O)OC

Isomeric SMILES

COC1=C(C=C(C=C1)CCNCC(COC2=CC=C(C=C2)COCC3=NC=CN3)O)OC

InChI

InChI=1S/C24H31N3O5/c1-29-22-8-5-18(13-23(22)30-2)9-10-25-14-20(28)16-32-21-6-3-19(4-7-21)15-31-17-24-26-11-12-27-24/h3-8,11-13,20,25,28H,9-10,14-17H2,1-2H3,(H,26,27)