tert-butyl 2-[[3-(diethylcarbamoyl)phenyl]carbamoyl]pyrrolidine-1-carboxylate

Systemtic Name: tert-butyl 2-[[3-(diethylcarbamoyl)phenyl]carbamoyl]pyrrolidine-1-carboxylate Openeye Name: tert-butyl 2-[[3-(diethylcarbamoyl)phenyl]carbamoyl]pyrrolidine-1-carboxylate CAS Name: 2-[[3-[diethylamino(oxo)methyl]anilino]-oxomethyl]-1-pyrrolidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 2-[[3-(diethylcarbamoyl)phenyl]carbamoyl]pyrrolidine-1-carboxylate Traditional Name: 2-[[3-(diethylcarbamoyl)phenyl]carbamoyl]pyrrolidine-1-carboxylic acid tert-butyl ester Formula: C21H31N3O4 MolecularWeight: 389.48854

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C(=O)C1=CC(=CC=C1)NC(=O)C2CCCN2C(=O)OC(C)(C)C

Isomeric SMILES

CCN(CC)C(=O)C1=CC(=CC=C1)NC(=O)C2CCCN2C(=O)OC(C)(C)C

InChI

InChI=1S/C21H31N3O4/c1-6-23(7-2)19(26)15-10-8-11-16(14-15)22-18(25)17-12-9-13-24(17)20(27)28-21(3,4)5/h8,10-11,14,17H,6-7,9,12-13H2,1-5H3,(H,22,25)