(2S)-1-[[(2-methylpropan-2-yl)oxycarbonylamino]-(phenylmethyl)carbamoyl]pyrrolidine-2-carboxylic acid

Systemtic Name: (2S)-1-[[(2-methylpropan-2-yl)oxycarbonylamino]-(phenylmethyl)carbamoyl]pyrrolidine-2-carboxylic acid Openeye Name: (2S)-1-[benzyl-(tert-butoxycarbonylamino)carbamoyl]pyrrolidine-2-carboxylic acid CAS Name: (2S)-1-[[[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-(phenylmethyl)amino]-oxomethyl]-2-pyrrolidinecarboxylic acid IUPAC Name: (2S)-1-[benzyl-[(2-methylpropan-2-yl)oxycarbonylamino]carbamoyl]pyrrolidine-2-carboxylic acid Traditional Name: (2S)-1-[benzyl-(tert-butoxycarbonylamino)carbamoyl]proline Formula: C18H25N3O5 MolecularWeight: 363.4082

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H25N3O5/c1-18(2,3)26-16(24)19-21(12-13-8-5-4-6-9-13)17(25)20-11-7-10-14(20)15(22)23/h4-6,8-9,14H,7,10-12H2,1-3H3,(H,19,24)(H,22,23)/t14-/m0/s1