(phenylmethyl) (2S)-1-[(2S)-2-[(2-methylpropan-2-yl)oxycarbonylamino]-4-oxidanylidene-4-phenyl-butanoyl]pyrrolidine-2-carboxylate

Systemtic Name: (phenylmethyl) (2S)-1-[(2S)-2-[(2-methylpropan-2-yl)oxycarbonylamino]-4-oxidanylidene-4-phenyl-butanoyl]pyrrolidine-2-carboxylate Openeye Name: benzyl (2S)-1-[(2S)-2-(tert-butoxycarbonylamino)-4-oxo-4-phenyl-butanoyl]pyrrolidine-2-carboxylate CAS Name: (2S)-1-[(2S)-2-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-1,4-dioxo-4-phenylbutyl]-2-pyrrolidinecarboxylic acid (phenylmethyl) ester IUPAC Name: benzyl (2S)-1-[(2S)-2-[(2-methylpropan-2-yl)oxycarbonylamino]-4-oxo-4-phenylbutanoyl]pyrrolidine-2-carboxylate Traditional Name: (2S)-1-[(2S)-2-(tert-butoxycarbonylamino)-4-keto-4-phenyl-butanoyl]pyrrolidine-2-carboxylic acid benzyl ester Formula: C27H32N2O6 MolecularWeight: 480.55278

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NC(CC(=O)C1=CC=CC=C1)C(=O)N2CCCC2C(=O)OCC3=CC=CC=C3

Isomeric SMILES

CC(C)(C)OC(=O)N[C@@H](CC(=O)C1=CC=CC=C1)C(=O)N2CCC[C@H]2C(=O)OCC3=CC=CC=C3

InChI

InChI=1S/C27H32N2O6/c1-27(2,3)35-26(33)28-21(17-23(30)20-13-8-5-9-14-20)24(31)29-16-10-15-22(29)25(32)34-18-19-11-6-4-7-12-19/h4-9,11-14,21-22H,10,15-18H2,1-3H3,(H,28,33)/t21-,22-/m0/s1