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

Systemtic Name: 4-[1-(4-methoxyphenyl)propan-2-yl-propyl-amino]butyl 3,4,5-trimethoxybenzoate Openeye Name: 4-[[2-(4-methoxyphenyl)-1-methyl-ethyl]-propyl-amino]butyl 3,4,5-trimethoxybenzoate CAS Name: 3,4,5-trimethoxybenzoic acid 4-[1-(4-methoxyphenyl)propan-2-yl-propylamino]butyl ester IUPAC Name: 4-[1-(4-methoxyphenyl)propan-2-yl-propylamino]butyl 3,4,5-trimethoxybenzoate Traditional Name: 3,4,5-trimethoxybenzoic acid 4-[[2-(4-methoxyphenyl)-1-methyl-ethyl]-propyl-amino]butyl ester Formula: C27H39NO6 MolecularWeight: 473.60166

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C27H39NO6/c1-7-14-28(20(2)17-21-10-12-23(30-3)13-11-21)15-8-9-16-34-27(29)22-18-24(31-4)26(33-6)25(19-22)32-5/h10-13,18-20H,7-9,14-17H2,1-6H3