4-[1-(3,4-dimethoxyphenyl)propan-2-yl-ethyl-amino]butyl 3,4,5-trimethoxybenzoate

Systemtic Name: 4-[1-(3,4-dimethoxyphenyl)propan-2-yl-ethyl-amino]butyl 3,4,5-trimethoxybenzoate Openeye Name: 4-[[2-(3,4-dimethoxyphenyl)-1-methyl-ethyl]-ethyl-amino]butyl 3,4,5-trimethoxybenzoate CAS Name: 3,4,5-trimethoxybenzoic acid 4-[1-(3,4-dimethoxyphenyl)propan-2-yl-ethylamino]butyl ester IUPAC Name: 4-[1-(3,4-dimethoxyphenyl)propan-2-yl-ethylamino]butyl 3,4,5-trimethoxybenzoate Traditional Name: 3,4,5-trimethoxybenzoic acid 4-[[2-(3,4-dimethoxyphenyl)-1-methyl-ethyl]-ethyl-amino]butyl ester Formula: C27H39NO7 MolecularWeight: 489.60106

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CCCCOC(=O)C1=CC(=C(C(=C1)OC)OC)OC)C(C)CC2=CC(=C(C=C2)OC)OC

Isomeric SMILES

CCN(CCCCOC(=O)C1=CC(=C(C(=C1)OC)OC)OC)C(C)CC2=CC(=C(C=C2)OC)OC

InChI

InChI=1S/C27H39NO7/c1-8-28(19(2)15-20-11-12-22(30-3)23(16-20)31-4)13-9-10-14-35-27(29)21-17-24(32-5)26(34-7)25(18-21)33-6/h11-12,16-19H,8-10,13-15H2,1-7H3