(phenylmethyl) (3S)-3-azanyl-4-[[(2S)-3-cyclohexyl-1-oxidanylidene-1-phenylmethoxy-propan-2-yl]amino]-4-oxidanylidene-butanoate

Systemtic Name: (phenylmethyl) (3S)-3-azanyl-4-[[(2S)-3-cyclohexyl-1-oxidanylidene-1-phenylmethoxy-propan-2-yl]amino]-4-oxidanylidene-butanoate Openeye Name: benzyl (3S)-3-amino-4-[[(1S)-2-benzyloxy-1-(cyclohexylmethyl)-2-oxo-ethyl]amino]-4-oxo-butanoate CAS Name: (3S)-3-amino-4-[[(2S)-3-cyclohexyl-1-oxo-1-phenylmethoxypropan-2-yl]amino]-4-oxobutanoic acid (phenylmethyl) ester IUPAC Name: benzyl (3S)-3-amino-4-[[(2S)-3-cyclohexyl-1-oxo-1-phenylmethoxypropan-2-yl]amino]-4-oxobutanoate Traditional Name: (3S)-3-amino-4-[[(1S)-2-benzoxy-1-(cyclohexylmethyl)-2-keto-ethyl]amino]-4-keto-butyric acid benzyl ester Formula: C27H34N2O5 MolecularWeight: 466.56926

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)CC(C(=O)OCC2=CC=CC=C2)NC(=O)C(CC(=O)OCC3=CC=CC=C3)N

Isomeric SMILES

C1CCC(CC1)C[C@@H](C(=O)OCC2=CC=CC=C2)NC(=O)[C@H](CC(=O)OCC3=CC=CC=C3)N

InChI

InChI=1S/C27H34N2O5/c28-23(17-25(30)33-18-21-12-6-2-7-13-21)26(31)29-24(16-20-10-4-1-5-11-20)27(32)34-19-22-14-8-3-9-15-22/h2-3,6-9,12-15,20,23-24H,1,4-5,10-11,16-19,28H2,(H,29,31)/t23-,24-/m0/s1