5-[[(4-ethoxyphenyl)methyl-[(3-fluorophenyl)methyl]amino]methyl]-N-pentyl-furan-2-carboxamide

Systemtic Name: 5-[[(4-ethoxyphenyl)methyl-[(3-fluorophenyl)methyl]amino]methyl]-N-pentyl-furan-2-carboxamide Openeye Name: 5-[[(4-ethoxyphenyl)methyl-[(3-fluorophenyl)methyl]amino]methyl]-N-pentyl-furan-2-carboxamide CAS Name: 5-[[(4-ethoxyphenyl)methyl-[(3-fluorophenyl)methyl]amino]methyl]-N-pentyl-2-furancarboxamide IUPAC Name: 5-[[(4-ethoxyphenyl)methyl-[(3-fluorophenyl)methyl]amino]methyl]-N-pentylfuran-2-carboxamide Traditional Name: N-amyl-5-[[(4-ethoxybenzyl)-(3-fluorobenzyl)amino]methyl]-2-furamide Formula: C27H33FN2O3 MolecularWeight: 452.560923

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCNC(=O)C1=CC=C(O1)CN(CC2=CC=C(C=C2)OCC)CC3=CC(=CC=C3)F

Isomeric SMILES

CCCCCNC(=O)C1=CC=C(O1)CN(CC2=CC=C(C=C2)OCC)CC3=CC(=CC=C3)F

InChI

InChI=1S/C27H33FN2O3/c1-3-5-6-16-29-27(31)26-15-14-25(33-26)20-30(19-22-8-7-9-23(28)17-22)18-21-10-12-24(13-11-21)32-4-2/h7-15,17H,3-6,16,18-20H2,1-2H3,(H,29,31)