(4S)-5-oxidanylidene-5-phenoxy-4-[[(2S)-2-(phenylmethoxycarbonylamino)propanoyl]amino]pentanoate

Systemtic Name: (4S)-5-oxidanylidene-5-phenoxy-4-[[(2S)-2-(phenylmethoxycarbonylamino)propanoyl]amino]pentanoate Openeye Name: (4S)-4-[[(2S)-2-(benzyloxycarbonylamino)propanoyl]amino]-5-oxo-5-phenoxy-pentanoate CAS Name: (4S)-5-oxo-4-[[(2S)-1-oxo-2-(phenylmethoxycarbonylamino)propyl]amino]-5-phenoxypentanoate IUPAC Name: (4S)-5-oxo-5-phenoxy-4-[[(2S)-2-(phenylmethoxycarbonylamino)propanoyl]amino]pentanoate Traditional Name: (4S)-4-[[(2S)-2-(benzyloxycarbonylamino)propanoyl]amino]-5-keto-5-phenoxy-valerate Formula: C22H23N2O7- MolecularWeight: 427.42722

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC(CCC(=O)[O-])C(=O)OC1=CC=CC=C1)NC(=O)OCC2=CC=CC=C2

Isomeric SMILES

C[C@@H](C(=O)N[C@@H](CCC(=O)[O-])C(=O)OC1=CC=CC=C1)NC(=O)OCC2=CC=CC=C2

InChI

InChI=1S/C22H24N2O7/c1-15(23-22(29)30-14-16-8-4-2-5-9-16)20(27)24-18(12-13-19(25)26)21(28)31-17-10-6-3-7-11-17/h2-11,15,18H,12-14H2,1H3,(H,23,29)(H,24,27)(H,25,26)/p-1/t15-,18-/m0/s1