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

Systemtic Name: tert-butyl 4-[4-[[4-(phenylcarbonyl)phenyl]carbamoyl]phenyl]piperazine-1-carboxylate Openeye Name: tert-butyl 4-[4-[(4-benzoylphenyl)carbamoyl]phenyl]piperazine-1-carboxylate CAS Name: 4-[4-[(4-benzoylanilino)-oxomethyl]phenyl]-1-piperazinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-[4-[(4-benzoylphenyl)carbamoyl]phenyl]piperazine-1-carboxylate Traditional Name: 4-[4-[(4-benzoylphenyl)carbamoyl]phenyl]piperazine-1-carboxylic acid tert-butyl ester Formula: C29H31N3O4 MolecularWeight: 485.57414

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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(=O)C4=CC=CC=C4

Isomeric SMILES

CC(C)(C)OC(=O)N1CCN(CC1)C2=CC=C(C=C2)C(=O)NC3=CC=C(C=C3)C(=O)C4=CC=CC=C4

InChI

InChI=1S/C29H31N3O4/c1-29(2,3)36-28(35)32-19-17-31(18-20-32)25-15-11-23(12-16-25)27(34)30-24-13-9-22(10-14-24)26(33)21-7-5-4-6-8-21/h4-16H,17-20H2,1-3H3,(H,30,34)