methyl (2S)-2-[[4-[methyl(phenylmethoxycarbonyl)amino]phenyl]carbonylamino]-4-phenylselanyl-butanoate

Systemtic Name: methyl (2S)-2-[[4-[methyl(phenylmethoxycarbonyl)amino]phenyl]carbonylamino]-4-phenylselanyl-butanoate Openeye Name: methyl (2S)-2-[[4-[benzyloxycarbonyl(methyl)amino]benzoyl]amino]-4-phenylselanyl-butanoate CAS Name: (2S)-2-[[[4-[methyl(phenylmethoxycarbonyl)amino]phenyl]-oxomethyl]amino]-4-(phenylseleno)butanoic acid methyl ester IUPAC Name: methyl (2S)-2-[[4-[methyl(phenylmethoxycarbonyl)amino]benzoyl]amino]-4-phenylselanylbutanoate Traditional Name: (2S)-2-[[4-[carbobenzoxy(methyl)amino]benzoyl]amino]-4-(phenylseleno)butyric acid methyl ester Formula: C27H28N2O5Se MolecularWeight: 539.48162

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Descriptors Computed from Structure

Canonical SMILES:

CN(C1=CC=C(C=C1)C(=O)NC(CC[Se]C2=CC=CC=C2)C(=O)OC)C(=O)OCC3=CC=CC=C3

Isomeric SMILES

CN(C1=CC=C(C=C1)C(=O)N[C@@H](CC[Se]C2=CC=CC=C2)C(=O)OC)C(=O)OCC3=CC=CC=C3

InChI

InChI=1S/C27H28N2O5Se/c1-29(27(32)34-19-20-9-5-3-6-10-20)22-15-13-21(14-16-22)25(30)28-24(26(31)33-2)17-18-35-23-11-7-4-8-12-23/h3-16,24H,17-19H2,1-2H3,(H,28,30)/t24-/m0/s1