tert-butyl 4-[4-[(4-cyanophenyl)carbamoyl]phenyl]piperazine-1-carboxylate

Systemtic Name: tert-butyl 4-[4-[(4-cyanophenyl)carbamoyl]phenyl]piperazine-1-carboxylate Openeye Name: tert-butyl 4-[4-[(4-cyanophenyl)carbamoyl]phenyl]piperazine-1-carboxylate CAS Name: 4-[4-[(4-cyanoanilino)-oxomethyl]phenyl]-1-piperazinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-[4-[(4-cyanophenyl)carbamoyl]phenyl]piperazine-1-carboxylate Traditional Name: 4-[4-[(4-cyanophenyl)carbamoyl]phenyl]piperazine-1-carboxylic acid tert-butyl ester Formula: C23H26N4O3 MolecularWeight: 406.47754

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCN(CC1)C2=CC=C(C=C2)C(=O)NC3=CC=C(C=C3)C#N

Isomeric SMILES

CC(C)(C)OC(=O)N1CCN(CC1)C2=CC=C(C=C2)C(=O)NC3=CC=C(C=C3)C#N

InChI

InChI=1S/C23H26N4O3/c1-23(2,3)30-22(29)27-14-12-26(13-15-27)20-10-6-18(7-11-20)21(28)25-19-8-4-17(16-24)5-9-19/h4-11H,12-15H2,1-3H3,(H,25,28)