3-[[5-(diethylcarbamoyl)-2-pentoxy-phenoxy]methyl]benzoic acid

Systemtic Name: 3-[[5-(diethylcarbamoyl)-2-pentoxy-phenoxy]methyl]benzoic acid Openeye Name: 3-[[5-(diethylcarbamoyl)-2-pentoxy-phenoxy]methyl]benzoic acid CAS Name: 3-[[5-[diethylamino(oxo)methyl]-2-pentoxyphenoxy]methyl]benzoic acid IUPAC Name: 3-[[5-(diethylcarbamoyl)-2-pentoxyphenoxy]methyl]benzoic acid Traditional Name: 3-[[2-amoxy-5-(diethylcarbamoyl)phenoxy]methyl]benzoic acid Formula: C24H31NO5 MolecularWeight: 413.50664

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCOC1=C(C=C(C=C1)C(=O)N(CC)CC)OCC2=CC=CC(=C2)C(=O)O

Isomeric SMILES

CCCCCOC1=C(C=C(C=C1)C(=O)N(CC)CC)OCC2=CC=CC(=C2)C(=O)O

InChI

InChI=1S/C24H31NO5/c1-4-7-8-14-29-21-13-12-19(23(26)25(5-2)6-3)16-22(21)30-17-18-10-9-11-20(15-18)24(27)28/h9-13,15-16H,4-8,14,17H2,1-3H3,(H,27,28)