(phenylmethyl) 1-[(2S)-2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-phenyl-propanoyl]pyrrolidine-2-carboxylate

Systemtic Name: (phenylmethyl) 1-[(2S)-2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-phenyl-propanoyl]pyrrolidine-2-carboxylate Openeye Name: benzyl 1-[(2S)-2-(tert-butoxycarbonylamino)-3-phenyl-propanoyl]pyrrolidine-2-carboxylate CAS Name: 1-[(2S)-2-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-1-oxo-3-phenylpropyl]-2-pyrrolidinecarboxylic acid (phenylmethyl) ester IUPAC Name: benzyl 1-[(2S)-2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-phenylpropanoyl]pyrrolidine-2-carboxylate Traditional Name: 1-[(2S)-2-(tert-butoxycarbonylamino)-3-phenyl-propanoyl]pyrrolidine-2-carboxylic acid benzyl ester Formula: C26H32N2O5 MolecularWeight: 452.54268

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NC(CC1=CC=CC=C1)C(=O)N2CCCC2C(=O)OCC3=CC=CC=C3

Isomeric SMILES

CC(C)(C)OC(=O)N[C@@H](CC1=CC=CC=C1)C(=O)N2CCCC2C(=O)OCC3=CC=CC=C3

InChI

InChI=1S/C26H32N2O5/c1-26(2,3)33-25(31)27-21(17-19-11-6-4-7-12-19)23(29)28-16-10-15-22(28)24(30)32-18-20-13-8-5-9-14-20/h4-9,11-14,21-22H,10,15-18H2,1-3H3,(H,27,31)/t21-,22?/m0/s1