butyl 4-[[(2S)-2-(phenylmethoxycarbonylamino)propanoyl]amino]benzoate

Systemtic Name: butyl 4-[[(2S)-2-(phenylmethoxycarbonylamino)propanoyl]amino]benzoate Openeye Name: butyl 4-[[(2S)-2-(benzyloxycarbonylamino)propanoyl]amino]benzoate CAS Name: 4-[[(2S)-1-oxo-2-(phenylmethoxycarbonylamino)propyl]amino]benzoic acid butyl ester IUPAC Name: butyl 4-[[(2S)-2-(phenylmethoxycarbonylamino)propanoyl]amino]benzoate Traditional Name: 4-[[(2S)-2-(benzyloxycarbonylamino)propanoyl]amino]benzoic acid butyl ester Formula: C22H26N2O5 MolecularWeight: 398.45224

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)C1=CC=C(C=C1)NC(=O)C(C)NC(=O)OCC2=CC=CC=C2

Isomeric SMILES

CCCCOC(=O)C1=CC=C(C=C1)NC(=O)[C@H](C)NC(=O)OCC2=CC=CC=C2

InChI

InChI=1S/C22H26N2O5/c1-3-4-14-28-21(26)18-10-12-19(13-11-18)24-20(25)16(2)23-22(27)29-15-17-8-6-5-7-9-17/h5-13,16H,3-4,14-15H2,1-2H3,(H,23,27)(H,24,25)/t16-/m0/s1