tert-butyl 4-[4-(furan-2-ylcarbonylamino)phenyl]carbonylpiperazine-1-carboxylate

Systemtic Name: tert-butyl 4-[4-(furan-2-ylcarbonylamino)phenyl]carbonylpiperazine-1-carboxylate Openeye Name: tert-butyl 4-[4-(furan-2-carbonylamino)benzoyl]piperazine-1-carboxylate CAS Name: 4-[[4-[[2-furanyl(oxo)methyl]amino]phenyl]-oxomethyl]-1-piperazinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-[4-(furan-2-carbonylamino)benzoyl]piperazine-1-carboxylate Traditional Name: 4-[4-(2-furoylamino)benzoyl]piperazine-1-carboxylic acid tert-butyl ester Formula: C21H25N3O5 MolecularWeight: 399.4403

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCN(CC1)C(=O)C2=CC=C(C=C2)NC(=O)C3=CC=CO3

Isomeric SMILES

CC(C)(C)OC(=O)N1CCN(CC1)C(=O)C2=CC=C(C=C2)NC(=O)C3=CC=CO3

InChI

InChI=1S/C21H25N3O5/c1-21(2,3)29-20(27)24-12-10-23(11-13-24)19(26)15-6-8-16(9-7-15)22-18(25)17-5-4-14-28-17/h4-9,14H,10-13H2,1-3H3,(H,22,25)