ethyl 2-[[(2S)-2-(dioctylamino)-3-phenyl-propanoyl]amino]ethanoate

Systemtic Name: ethyl 2-[[(2S)-2-(dioctylamino)-3-phenyl-propanoyl]amino]ethanoate Openeye Name: ethyl 2-[[(2S)-2-(dioctylamino)-3-phenyl-propanoyl]amino]acetate CAS Name: 2-[[(2S)-2-(dioctylamino)-1-oxo-3-phenylpropyl]amino]acetic acid ethyl ester IUPAC Name: ethyl 2-[[(2S)-2-(dioctylamino)-3-phenylpropanoyl]amino]acetate Traditional Name: 2-[[(2S)-2-(dioctylamino)-3-phenyl-propanoyl]amino]acetic acid ethyl ester Formula: C29H50N2O3 MolecularWeight: 474.7189

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCN(CCCCCCCC)C(CC1=CC=CC=C1)C(=O)NCC(=O)OCC

Isomeric SMILES

CCCCCCCCN(CCCCCCCC)[C@@H](CC1=CC=CC=C1)C(=O)NCC(=O)OCC

InChI

InChI=1S/C29H50N2O3/c1-4-7-9-11-13-18-22-31(23-19-14-12-10-8-5-2)27(24-26-20-16-15-17-21-26)29(33)30-25-28(32)34-6-3/h15-17,20-21,27H,4-14,18-19,22-25H2,1-3H3,(H,30,33)/t27-/m0/s1