methyl 4-[2-[[(2S)-4-phenyl-2-(phenylmethoxycarbonylamino)butanoyl]amino]ethyl]benzoate

Systemtic Name: methyl 4-[2-[[(2S)-4-phenyl-2-(phenylmethoxycarbonylamino)butanoyl]amino]ethyl]benzoate Openeye Name: methyl 4-[2-[[(2S)-2-(benzyloxycarbonylamino)-4-phenyl-butanoyl]amino]ethyl]benzoate CAS Name: 4-[2-[[(2S)-1-oxo-4-phenyl-2-(phenylmethoxycarbonylamino)butyl]amino]ethyl]benzoic acid methyl ester IUPAC Name: methyl 4-[2-[[(2S)-4-phenyl-2-(phenylmethoxycarbonylamino)butanoyl]amino]ethyl]benzoate Traditional Name: 4-[2-[[(2S)-2-(benzyloxycarbonylamino)-4-phenyl-butanoyl]amino]ethyl]benzoic acid methyl ester Formula: C28H30N2O5 MolecularWeight: 474.5482

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)CCNC(=O)C(CCC2=CC=CC=C2)NC(=O)OCC3=CC=CC=C3

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)CCNC(=O)[C@H](CCC2=CC=CC=C2)NC(=O)OCC3=CC=CC=C3

InChI

InChI=1S/C28H30N2O5/c1-34-27(32)24-15-12-22(13-16-24)18-19-29-26(31)25(17-14-21-8-4-2-5-9-21)30-28(33)35-20-23-10-6-3-7-11-23/h2-13,15-16,25H,14,17-20H2,1H3,(H,29,31)(H,30,33)/t25-/m0/s1