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

Systemtic Name: 1-[2-(3,4-dimethoxyphenyl)ethylamino]-3-[2-(prop-2-ynoxymethyl)phenoxy]propan-2-ol Openeye Name: 1-[2-(3,4-dimethoxyphenyl)ethylamino]-3-[2-(prop-2-ynoxymethyl)phenoxy]propan-2-ol CAS Name: 1-[2-(3,4-dimethoxyphenyl)ethylamino]-3-[2-(prop-2-ynoxymethyl)phenoxy]-2-propanol IUPAC Name: 1-[2-(3,4-dimethoxyphenyl)ethylamino]-3-[2-(prop-2-ynoxymethyl)phenoxy]propan-2-ol Traditional Name: 1-(homoveratrylamino)-3-[2-(propargyloxymethyl)phenoxy]propan-2-ol Formula: C23H29NO5 MolecularWeight: 399.48006

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CCNCC(COC2=CC=CC=C2COCC#C)O)OC

Isomeric SMILES

COC1=C(C=C(C=C1)CCNCC(COC2=CC=CC=C2COCC#C)O)OC

InChI

InChI=1S/C23H29NO5/c1-4-13-28-16-19-7-5-6-8-21(19)29-17-20(25)15-24-12-11-18-9-10-22(26-2)23(14-18)27-3/h1,5-10,14,20,24-25H,11-13,15-17H2,2-3H3