4-[phenethyl(propyl)amino]butyl 3,4,5-trimethoxybenzoate

Systemtic Name: 4-[phenethyl(propyl)amino]butyl 3,4,5-trimethoxybenzoate Openeye Name: 4-[phenethyl(propyl)amino]butyl 3,4,5-trimethoxybenzoate CAS Name: 3,4,5-trimethoxybenzoic acid 4-[phenethyl(propyl)amino]butyl ester IUPAC Name: 4-[phenethyl(propyl)amino]butyl 3,4,5-trimethoxybenzoate Traditional Name: 3,4,5-trimethoxybenzoic acid 4-[phenethyl(propyl)amino]butyl ester Formula: C25H35NO5 MolecularWeight: 429.5491

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Descriptors Computed from Structure

Canonical SMILES:

CCCN(CCCCOC(=O)C1=CC(=C(C(=C1)OC)OC)OC)CCC2=CC=CC=C2

Isomeric SMILES

CCCN(CCCCOC(=O)C1=CC(=C(C(=C1)OC)OC)OC)CCC2=CC=CC=C2

InChI

InChI=1S/C25H35NO5/c1-5-14-26(16-13-20-11-7-6-8-12-20)15-9-10-17-31-25(27)21-18-22(28-2)24(30-4)23(19-21)29-3/h6-8,11-12,18-19H,5,9-10,13-17H2,1-4H3