2-[[(2S)-2,5-bis(phenylmethoxycarbonylamino)pentanoyl]amino]ethanesulfonic acid

Systemtic Name: 2-[[(2S)-2,5-bis(phenylmethoxycarbonylamino)pentanoyl]amino]ethanesulfonic acid Openeye Name: 2-[[(2S)-2,5-bis(benzyloxycarbonylamino)pentanoyl]amino]ethanesulfonic acid CAS Name: 2-[[(2S)-1-oxo-2,5-bis(phenylmethoxycarbonylamino)pentyl]amino]ethanesulfonic acid IUPAC Name: 2-[[(2S)-2,5-bis(phenylmethoxycarbonylamino)pentanoyl]amino]ethanesulfonic acid Traditional Name: 2-[[(2S)-2,5-bis(benzyloxycarbonylamino)pentanoyl]amino]ethanesulfonic acid Formula: C23H29N3O8S MolecularWeight: 507.55666

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC(=O)NCCCC(C(=O)NCCS(=O)(=O)O)NC(=O)OCC2=CC=CC=C2

Isomeric SMILES

C1=CC=C(C=C1)COC(=O)NCCC[C@@H](C(=O)NCCS(=O)(=O)O)NC(=O)OCC2=CC=CC=C2

InChI

InChI=1S/C23H29N3O8S/c27-21(24-14-15-35(30,31)32)20(26-23(29)34-17-19-10-5-2-6-11-19)12-7-13-25-22(28)33-16-18-8-3-1-4-9-18/h1-6,8-11,20H,7,12-17H2,(H,24,27)(H,25,28)(H,26,29)(H,30,31,32)/t20-/m0/s1