methyl (2S)-2-[[(2S)-2-azanyl-3-phenyl-propanoyl]-(phenylmethyl)amino]hexanoate

Systemtic Name: methyl (2S)-2-[[(2S)-2-azanyl-3-phenyl-propanoyl]-(phenylmethyl)amino]hexanoate Openeye Name: methyl (2S)-2-[[(2S)-2-amino-3-phenyl-propanoyl]-benzyl-amino]hexanoate CAS Name: (2S)-2-[[(2S)-2-amino-1-oxo-3-phenylpropyl]-(phenylmethyl)amino]hexanoic acid methyl ester IUPAC Name: methyl (2S)-2-[[(2S)-2-amino-3-phenylpropanoyl]-benzylamino]hexanoate Traditional Name: (2S)-2-[[(2S)-2-amino-3-phenyl-propanoyl]-benzyl-amino]hexanoic acid methyl ester Formula: C23H30N2O3 MolecularWeight: 382.4959

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(C(=O)OC)N(CC1=CC=CC=C1)C(=O)C(CC2=CC=CC=C2)N

Isomeric SMILES

CCCC[C@@H](C(=O)OC)N(CC1=CC=CC=C1)C(=O)[C@H](CC2=CC=CC=C2)N

InChI

InChI=1S/C23H30N2O3/c1-3-4-15-21(23(27)28-2)25(17-19-13-9-6-10-14-19)22(26)20(24)16-18-11-7-5-8-12-18/h5-14,20-21H,3-4,15-17,24H2,1-2H3/t20-,21-/m0/s1