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

Systemtic Name: (phenylmethyl) (2S)-1-[(2S)-4-methoxy-2-[(2-methylpropan-2-yl)oxycarbonylamino]-4-oxidanylidene-butanoyl]pyrrolidine-2-carboxylate Openeye Name: benzyl (2S)-1-[(2S)-2-(tert-butoxycarbonylamino)-4-methoxy-4-oxo-butanoyl]pyrrolidine-2-carboxylate CAS Name: (2S)-1-[(2S)-4-methoxy-2-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-1,4-dioxobutyl]-2-pyrrolidinecarboxylic acid (phenylmethyl) ester IUPAC Name: benzyl (2S)-1-[(2S)-4-methoxy-2-[(2-methylpropan-2-yl)oxycarbonylamino]-4-oxobutanoyl]pyrrolidine-2-carboxylate Traditional Name: (2S)-1-[(2S)-2-(tert-butoxycarbonylamino)-4-keto-4-methoxy-butanoyl]pyrrolidine-2-carboxylic acid benzyl ester Formula: C22H30N2O7 MolecularWeight: 434.4828

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NC(CC(=O)OC)C(=O)N1CCCC1C(=O)OCC2=CC=CC=C2

Isomeric SMILES

CC(C)(C)OC(=O)N[C@@H](CC(=O)OC)C(=O)N1CCC[C@H]1C(=O)OCC2=CC=CC=C2

InChI

InChI=1S/C22H30N2O7/c1-22(2,3)31-21(28)23-16(13-18(25)29-4)19(26)24-12-8-11-17(24)20(27)30-14-15-9-6-5-7-10-15/h5-7,9-10,16-17H,8,11-14H2,1-4H3,(H,23,28)/t16-,17-/m0/s1