ethyl 3-oxidanylidene-3-[[(5S)-6-oxidanylidene-6-phenylazanyl-5-(phenylmethoxycarbonylamino)hexyl]amino]propanoate

Systemtic Name: ethyl 3-oxidanylidene-3-[[(5S)-6-oxidanylidene-6-phenylazanyl-5-(phenylmethoxycarbonylamino)hexyl]amino]propanoate Openeye Name: ethyl 3-[[(5S)-6-anilino-5-(benzyloxycarbonylamino)-6-oxo-hexyl]amino]-3-oxo-propanoate CAS Name: 3-[[(5S)-6-anilino-6-oxo-5-(phenylmethoxycarbonylamino)hexyl]amino]-3-oxopropanoic acid ethyl ester IUPAC Name: ethyl 3-[[(5S)-6-anilino-6-oxo-5-(phenylmethoxycarbonylamino)hexyl]amino]-3-oxopropanoate Traditional Name: 3-[[(5S)-6-anilino-5-(benzyloxycarbonylamino)-6-keto-hexyl]amino]-3-keto-propionic acid ethyl ester Formula: C25H31N3O6 MolecularWeight: 469.53014

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CC(=O)NCCCCC(C(=O)NC1=CC=CC=C1)NC(=O)OCC2=CC=CC=C2

Isomeric SMILES

CCOC(=O)CC(=O)NCCCC[C@@H](C(=O)NC1=CC=CC=C1)NC(=O)OCC2=CC=CC=C2

InChI

InChI=1S/C25H31N3O6/c1-2-33-23(30)17-22(29)26-16-10-9-15-21(24(31)27-20-13-7-4-8-14-20)28-25(32)34-18-19-11-5-3-6-12-19/h3-8,11-14,21H,2,9-10,15-18H2,1H3,(H,26,29)(H,27,31)(H,28,32)/t21-/m0/s1