[1-(4-hydroxyphenyl)-2-(4-oxidanylbutylamino)propyl] 3,4,5-trimethoxybenzoate

Systemtic Name: [1-(4-hydroxyphenyl)-2-(4-oxidanylbutylamino)propyl] 3,4,5-trimethoxybenzoate Openeye Name: [2-(4-hydroxybutylamino)-1-(4-hydroxyphenyl)propyl] 3,4,5-trimethoxybenzoate CAS Name: 3,4,5-trimethoxybenzoic acid [2-(4-hydroxybutylamino)-1-(4-hydroxyphenyl)propyl] ester IUPAC Name: [2-(4-hydroxybutylamino)-1-(4-hydroxyphenyl)propyl] 3,4,5-trimethoxybenzoate Traditional Name: 3,4,5-trimethoxybenzoic acid [2-(4-hydroxybutylamino)-1-(4-hydroxyphenyl)propyl] ester Formula: C23H31NO7 MolecularWeight: 433.49474

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(C1=CC=C(C=C1)O)OC(=O)C2=CC(=C(C(=C2)OC)OC)OC)NCCCCO

Isomeric SMILES

CC(C(C1=CC=C(C=C1)O)OC(=O)C2=CC(=C(C(=C2)OC)OC)OC)NCCCCO

InChI

InChI=1S/C23H31NO7/c1-15(24-11-5-6-12-25)21(16-7-9-18(26)10-8-16)31-23(27)17-13-19(28-2)22(30-4)20(14-17)29-3/h7-10,13-15,21,24-26H,5-6,11-12H2,1-4H3