[4-[2-[[2-(1-benzofuran-2-yl)-2-oxidanyl-ethyl]amino]propyl]phenyl] benzoate

Systemtic Name: [4-[2-[[2-(1-benzofuran-2-yl)-2-oxidanyl-ethyl]amino]propyl]phenyl] benzoate Openeye Name: [4-[2-[[2-(benzofuran-2-yl)-2-hydroxy-ethyl]amino]propyl]phenyl] benzoate CAS Name: benzoic acid [4-[2-[[2-(2-benzofuranyl)-2-hydroxyethyl]amino]propyl]phenyl] ester IUPAC Name: [4-[2-[[2-(1-benzofuran-2-yl)-2-hydroxyethyl]amino]propyl]phenyl] benzoate Traditional Name: benzoic acid [4-[2-[[2-(benzofuran-2-yl)-2-hydroxy-ethyl]amino]propyl]phenyl] ester Formula: C26H25NO4 MolecularWeight: 415.481

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC1=CC=C(C=C1)OC(=O)C2=CC=CC=C2)NCC(C3=CC4=CC=CC=C4O3)O

Isomeric SMILES

CC(CC1=CC=C(C=C1)OC(=O)C2=CC=CC=C2)NCC(C3=CC4=CC=CC=C4O3)O

InChI

InChI=1S/C26H25NO4/c1-18(27-17-23(28)25-16-21-9-5-6-10-24(21)31-25)15-19-11-13-22(14-12-19)30-26(29)20-7-3-2-4-8-20/h2-14,16,18,23,27-28H,15,17H2,1H3