4-[ethyl(1-phenylpropan-2-yl)amino]butan-1-ol; 3,4,5-trimethoxybenzoic acid

Systemtic Name: 4-[ethyl(1-phenylpropan-2-yl)amino]butan-1-ol; 3,4,5-trimethoxybenzoic acid Openeye Name: 4-[ethyl-(1-methyl-2-phenyl-ethyl)amino]butan-1-ol; 3,4,5-trimethoxybenzoic acid CAS Name: 4-[ethyl(1-phenylpropan-2-yl)amino]-1-butanol; 3,4,5-trimethoxybenzoic acid IUPAC Name: 4-[ethyl(1-phenylpropan-2-yl)amino]butan-1-ol; 3,4,5-trimethoxybenzoic acid Traditional Name: 4-[ethyl-(1-methyl-2-phenyl-ethyl)amino]butan-1-ol; 3,4,5-trimethoxybenzoic acid Formula: C25H37NO6 MolecularWeight: 447.56438

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CCCCO)C(C)CC1=CC=CC=C1.COC1=CC(=CC(=C1OC)OC)C(=O)O

Isomeric SMILES

CCN(CCCCO)C(C)CC1=CC=CC=C1.COC1=CC(=CC(=C1OC)OC)C(=O)O

InChI

InChI=1S/C15H25NO.C10H12O5/c1-3-16(11-7-8-12-17)14(2)13-15-9-5-4-6-10-15;1-13-7-4-6(10(11)12)5-8(14-2)9(7)15-3/h4-6,9-10,14,17H,3,7-8,11-13H2,1-2H3;4-5H,1-3H3,(H,11,12)