tert-butyl 1-[[(1-ethoxy-1-oxidanylidene-4-phenyl-butan-2-yl)amino]carbamoyl]pyrrolidine-2-carboxylate

Systemtic Name: tert-butyl 1-[[(1-ethoxy-1-oxidanylidene-4-phenyl-butan-2-yl)amino]carbamoyl]pyrrolidine-2-carboxylate Openeye Name: tert-butyl 1-[[(1-ethoxycarbonyl-3-phenyl-propyl)amino]carbamoyl]pyrrolidine-2-carboxylate CAS Name: 1-[[(1-ethoxy-1-oxo-4-phenylbutan-2-yl)hydrazo]-oxomethyl]-2-pyrrolidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 1-[[(1-ethoxy-1-oxo-4-phenylbutan-2-yl)amino]carbamoyl]pyrrolidine-2-carboxylate Traditional Name: 1-[[(1-carbethoxy-3-phenyl-propyl)amino]carbamoyl]pyrrolidine-2-carboxylic acid tert-butyl ester Formula: C22H33N3O5 MolecularWeight: 419.51452

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(CCC1=CC=CC=C1)NNC(=O)N2CCCC2C(=O)OC(C)(C)C

Isomeric SMILES

CCOC(=O)C(CCC1=CC=CC=C1)NNC(=O)N2CCCC2C(=O)OC(C)(C)C

InChI

InChI=1S/C22H33N3O5/c1-5-29-19(26)17(14-13-16-10-7-6-8-11-16)23-24-21(28)25-15-9-12-18(25)20(27)30-22(2,3)4/h6-8,10-11,17-18,23H,5,9,12-15H2,1-4H3,(H,24,28)