methyl 2-[3-[2-(3,4-dimethoxyphenyl)ethylamino]-2-oxidanyl-propoxy]benzoate

Systemtic Name: methyl 2-[3-[2-(3,4-dimethoxyphenyl)ethylamino]-2-oxidanyl-propoxy]benzoate Openeye Name: methyl 2-[3-[2-(3,4-dimethoxyphenyl)ethylamino]-2-hydroxy-propoxy]benzoate CAS Name: 2-[3-[2-(3,4-dimethoxyphenyl)ethylamino]-2-hydroxypropoxy]benzoic acid methyl ester IUPAC Name: methyl 2-[3-[2-(3,4-dimethoxyphenyl)ethylamino]-2-hydroxypropoxy]benzoate Traditional Name: 2-[3-(homoveratrylamino)-2-hydroxy-propoxy]benzoic acid methyl ester Formula: C21H27NO6 MolecularWeight: 389.44218

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CCNCC(COC2=CC=CC=C2C(=O)OC)O)OC

Isomeric SMILES

COC1=C(C=C(C=C1)CCNCC(COC2=CC=CC=C2C(=O)OC)O)OC

InChI

InChI=1S/C21H27NO6/c1-25-19-9-8-15(12-20(19)26-2)10-11-22-13-16(23)14-28-18-7-5-4-6-17(18)21(24)27-3/h4-9,12,16,22-23H,10-11,13-14H2,1-3H3