butyl 4-oxidanyl-2-[[2-(4-phenylbutyl)phenoxy]methyl]pyrrolidine-1-carboxylate

Systemtic Name: butyl 4-oxidanyl-2-[[2-(4-phenylbutyl)phenoxy]methyl]pyrrolidine-1-carboxylate Openeye Name: butyl 4-hydroxy-2-[[2-(4-phenylbutyl)phenoxy]methyl]pyrrolidine-1-carboxylate CAS Name: 4-hydroxy-2-[[2-(4-phenylbutyl)phenoxy]methyl]-1-pyrrolidinecarboxylic acid butyl ester IUPAC Name: butyl 4-hydroxy-2-[[2-(4-phenylbutyl)phenoxy]methyl]pyrrolidine-1-carboxylate Traditional Name: 4-hydroxy-2-[[2-(4-phenylbutyl)phenoxy]methyl]pyrrolidine-1-carboxylic acid butyl ester Formula: C26H35NO4 MolecularWeight: 425.5604

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)N1CC(CC1COC2=CC=CC=C2CCCCC3=CC=CC=C3)O

Isomeric SMILES

CCCCOC(=O)N1CC(CC1COC2=CC=CC=C2CCCCC3=CC=CC=C3)O

InChI

InChI=1S/C26H35NO4/c1-2-3-17-30-26(29)27-19-24(28)18-23(27)20-31-25-16-10-9-15-22(25)14-8-7-13-21-11-5-4-6-12-21/h4-6,9-12,15-16,23-24,28H,2-3,7-8,13-14,17-20H2,1H3