methyl (2S)-1-[[(2-methylpropan-2-yl)oxycarbonylamino]-(phenylmethyl)carbamoyl]pyrrolidine-2-carboxylate

Systemtic Name: methyl (2S)-1-[[(2-methylpropan-2-yl)oxycarbonylamino]-(phenylmethyl)carbamoyl]pyrrolidine-2-carboxylate Openeye Name: methyl (2S)-1-[benzyl-(tert-butoxycarbonylamino)carbamoyl]pyrrolidine-2-carboxylate CAS Name: (2S)-1-[[[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-(phenylmethyl)amino]-oxomethyl]-2-pyrrolidinecarboxylic acid methyl ester IUPAC Name: methyl (2S)-1-[benzyl-[(2-methylpropan-2-yl)oxycarbonylamino]carbamoyl]pyrrolidine-2-carboxylate Traditional Name: (2S)-1-[benzyl-(tert-butoxycarbonylamino)carbamoyl]pyrrolidine-2-carboxylic acid methyl ester Formula: C19H27N3O5 MolecularWeight: 377.43478

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NN(CC1=CC=CC=C1)C(=O)N2CCCC2C(=O)OC

Isomeric SMILES

CC(C)(C)OC(=O)NN(CC1=CC=CC=C1)C(=O)N2CCC[C@H]2C(=O)OC

InChI

InChI=1S/C19H27N3O5/c1-19(2,3)27-17(24)20-22(13-14-9-6-5-7-10-14)18(25)21-12-8-11-15(21)16(23)26-4/h5-7,9-10,15H,8,11-13H2,1-4H3,(H,20,24)/t15-/m0/s1