1-[2-(3,4-dimethoxyphenyl)ethylamino]-3-[4-(ethynoxymethyl)phenoxy]propan-2-ol

Systemtic Name: 1-[2-(3,4-dimethoxyphenyl)ethylamino]-3-[4-(ethynoxymethyl)phenoxy]propan-2-ol Openeye Name: 1-[2-(3,4-dimethoxyphenyl)ethylamino]-3-[4-(ethynoxymethyl)phenoxy]propan-2-ol CAS Name: 1-[2-(3,4-dimethoxyphenyl)ethylamino]-3-[4-(ethynoxymethyl)phenoxy]-2-propanol IUPAC Name: 1-[2-(3,4-dimethoxyphenyl)ethylamino]-3-[4-(ethynoxymethyl)phenoxy]propan-2-ol Traditional Name: 1-[4-(ethynoxymethyl)phenoxy]-3-(homoveratrylamino)propan-2-ol Formula: C22H27NO5 MolecularWeight: 385.45348

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CCNCC(COC2=CC=C(C=C2)COC#C)O)OC

Isomeric SMILES

COC1=C(C=C(C=C1)CCNCC(COC2=CC=C(C=C2)COC#C)O)OC

InChI

InChI=1S/C22H27NO5/c1-4-27-15-18-5-8-20(9-6-18)28-16-19(24)14-23-12-11-17-7-10-21(25-2)22(13-17)26-3/h1,5-10,13,19,23-24H,11-12,14-16H2,2-3H3