ethyl (2S,3S)-3-[bis(phenylmethyl)amino]-2-fluoranyl-5-phenyl-pentanoate

Systemtic Name: ethyl (2S,3S)-3-[bis(phenylmethyl)amino]-2-fluoranyl-5-phenyl-pentanoate Openeye Name: ethyl (2S,3S)-3-(dibenzylamino)-2-fluoro-5-phenyl-pentanoate CAS Name: (2S,3S)-3-[bis(phenylmethyl)amino]-2-fluoro-5-phenylpentanoic acid ethyl ester IUPAC Name: ethyl (2S,3S)-3-(dibenzylamino)-2-fluoro-5-phenylpentanoate Traditional Name: (2S,3S)-3-(dibenzylamino)-2-fluoro-5-phenyl-valeric acid ethyl ester Formula: C27H30FNO2 MolecularWeight: 419.531003

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(C(CCC1=CC=CC=C1)N(CC2=CC=CC=C2)CC3=CC=CC=C3)F

Isomeric SMILES

CCOC(=O)[C@H]([C@H](CCC1=CC=CC=C1)N(CC2=CC=CC=C2)CC3=CC=CC=C3)F

InChI

InChI=1S/C27H30FNO2/c1-2-31-27(30)26(28)25(19-18-22-12-6-3-7-13-22)29(20-23-14-8-4-9-15-23)21-24-16-10-5-11-17-24/h3-17,25-26H,2,18-21H2,1H3/t25-,26-/m0/s1