methyl 4-[[2-(4-nitrophenoxy)-2-oxidanylidene-ethyl]amino]-4-oxidanylidene-3-[[3-phenyl-2-(phenylmethoxycarbonylamino)propanoyl]amino]butanoate

Systemtic Name: methyl 4-[[2-(4-nitrophenoxy)-2-oxidanylidene-ethyl]amino]-4-oxidanylidene-3-[[3-phenyl-2-(phenylmethoxycarbonylamino)propanoyl]amino]butanoate Openeye Name: methyl 3-[[2-(benzyloxycarbonylamino)-3-phenyl-propanoyl]amino]-4-[[2-(4-nitrophenoxy)-2-oxo-ethyl]amino]-4-oxo-butanoate CAS Name: 4-[[2-(4-nitrophenoxy)-2-oxoethyl]amino]-4-oxo-3-[[1-oxo-3-phenyl-2-(phenylmethoxycarbonylamino)propyl]amino]butanoic acid methyl ester IUPAC Name: methyl 4-[[2-(4-nitrophenoxy)-2-oxoethyl]amino]-4-oxo-3-[[3-phenyl-2-(phenylmethoxycarbonylamino)propanoyl]amino]butanoate Traditional Name: 3-[[2-(benzyloxycarbonylamino)-3-phenyl-propanoyl]amino]-4-keto-4-[[2-keto-2-(4-nitrophenoxy)ethyl]amino]butyric acid methyl ester Formula: C30H30N4O10 MolecularWeight: 606.58

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CC(C(=O)NCC(=O)OC1=CC=C(C=C1)[N+](=O)[O-])NC(=O)C(CC2=CC=CC=C2)NC(=O)OCC3=CC=CC=C3

Isomeric SMILES

COC(=O)CC(C(=O)NCC(=O)OC1=CC=C(C=C1)[N+](=O)[O-])NC(=O)C(CC2=CC=CC=C2)NC(=O)OCC3=CC=CC=C3

InChI

InChI=1S/C30H30N4O10/c1-42-26(35)17-25(28(37)31-18-27(36)44-23-14-12-22(13-15-23)34(40)41)32-29(38)24(16-20-8-4-2-5-9-20)33-30(39)43-19-21-10-6-3-7-11-21/h2-15,24-25H,16-19H2,1H3,(H,31,37)(H,32,38)(H,33,39)