4-[1-(3,4-dimethoxyphenyl)propan-2-yl-ethyl-amino]butan-1-ol; 3,4,5-triethoxybenzoic acid

Systemtic Name: 4-[1-(3,4-dimethoxyphenyl)propan-2-yl-ethyl-amino]butan-1-ol; 3,4,5-triethoxybenzoic acid Openeye Name: 4-[[2-(3,4-dimethoxyphenyl)-1-methyl-ethyl]-ethyl-amino]butan-1-ol; 3,4,5-triethoxybenzoic acid CAS Name: 4-[1-(3,4-dimethoxyphenyl)propan-2-yl-ethylamino]-1-butanol; 3,4,5-triethoxybenzoic acid IUPAC Name: 4-[1-(3,4-dimethoxyphenyl)propan-2-yl-ethylamino]butan-1-ol; 3,4,5-triethoxybenzoic acid Traditional Name: 4-[[2-(3,4-dimethoxyphenyl)-1-methyl-ethyl]-ethyl-amino]butan-1-ol; 3,4,5-triethoxybenzoic acid Formula: C30H47NO8 MolecularWeight: 549.69608

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CCCCO)C(C)CC1=CC(=C(C=C1)OC)OC.CCOC1=CC(=CC(=C1OCC)OCC)C(=O)O

Isomeric SMILES

CCN(CCCCO)C(C)CC1=CC(=C(C=C1)OC)OC.CCOC1=CC(=CC(=C1OCC)OCC)C(=O)O

InChI

InChI=1S/C17H29NO3.C13H18O5/c1-5-18(10-6-7-11-19)14(2)12-15-8-9-16(20-3)17(13-15)21-4;1-4-16-10-7-9(13(14)15)8-11(17-5-2)12(10)18-6-3/h8-9,13-14,19H,5-7,10-12H2,1-4H3;7-8H,4-6H2,1-3H3,(H,14,15)