tert-butyl (E,2S)-6-oxidanylidene-2-[[(4S)-5-oxidanylidene-5-phenylmethoxy-4-(phenylmethoxycarbonylamino)pentanoyl]amino]dec-4-enoate

Systemtic Name: tert-butyl (E,2S)-6-oxidanylidene-2-[[(4S)-5-oxidanylidene-5-phenylmethoxy-4-(phenylmethoxycarbonylamino)pentanoyl]amino]dec-4-enoate Openeye Name: tert-butyl (E,2S)-2-[[(4S)-5-benzyloxy-4-(benzyloxycarbonylamino)-5-oxo-pentanoyl]amino]-6-oxo-dec-4-enoate CAS Name: (E,2S)-2-[[(4S)-1,5-dioxo-5-phenylmethoxy-4-(phenylmethoxycarbonylamino)pentyl]amino]-6-oxo-4-decenoic acid tert-butyl ester IUPAC Name: tert-butyl (E,2S)-6-oxo-2-[[(4S)-5-oxo-5-phenylmethoxy-4-(phenylmethoxycarbonylamino)pentanoyl]amino]dec-4-enoate Traditional Name: (E,2S)-2-[[(4S)-5-benzoxy-4-(benzyloxycarbonylamino)-5-keto-pentanoyl]amino]-6-keto-dec-4-enoic acid tert-butyl ester Formula: C34H44N2O8 MolecularWeight: 608.72176

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(=O)C=CCC(C(=O)OC(C)(C)C)NC(=O)CCC(C(=O)OCC1=CC=CC=C1)NC(=O)OCC2=CC=CC=C2

Isomeric SMILES

CCCCC(=O)/C=C/C[C@@H](C(=O)OC(C)(C)C)NC(=O)CC[C@@H](C(=O)OCC1=CC=CC=C1)NC(=O)OCC2=CC=CC=C2

InChI

InChI=1S/C34H44N2O8/c1-5-6-18-27(37)19-13-20-28(32(40)44-34(2,3)4)35-30(38)22-21-29(31(39)42-23-25-14-9-7-10-15-25)36-33(41)43-24-26-16-11-8-12-17-26/h7-17,19,28-29H,5-6,18,20-24H2,1-4H3,(H,35,38)(H,36,41)/b19-13+/t28-,29-/m0/s1