9-[(2-oxidanyl-2-phenyl-ethyl)amino]nonyl 4-phenylbutanoate

Systemtic Name: 9-[(2-oxidanyl-2-phenyl-ethyl)amino]nonyl 4-phenylbutanoate Openeye Name: 9-[(2-hydroxy-2-phenyl-ethyl)amino]nonyl 4-phenylbutanoate CAS Name: 4-phenylbutanoic acid 9-[(2-hydroxy-2-phenylethyl)amino]nonyl ester IUPAC Name: 9-[(2-hydroxy-2-phenylethyl)amino]nonyl 4-phenylbutanoate Traditional Name: 4-phenylbutyric acid 9-[(2-hydroxy-2-phenyl-ethyl)amino]nonyl ester Formula: C27H39NO3 MolecularWeight: 425.60346

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCCC(=O)OCCCCCCCCCNCC(C2=CC=CC=C2)O

Isomeric SMILES

C1=CC=C(C=C1)CCCC(=O)OCCCCCCCCCNCC(C2=CC=CC=C2)O

InChI

InChI=1S/C27H39NO3/c29-26(25-18-10-7-11-19-25)23-28-21-12-4-2-1-3-5-13-22-31-27(30)20-14-17-24-15-8-6-9-16-24/h6-11,15-16,18-19,26,28-29H,1-5,12-14,17,20-23H2