tert-butyl 4-[(3-ethanoylphenyl)carbamoyl]piperazine-1-carboxylate

Systemtic Name: tert-butyl 4-[(3-ethanoylphenyl)carbamoyl]piperazine-1-carboxylate Openeye Name: tert-butyl 4-[(3-acetylphenyl)carbamoyl]piperazine-1-carboxylate CAS Name: 4-[(3-acetylanilino)-oxomethyl]-1-piperazinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-[(3-acetylphenyl)carbamoyl]piperazine-1-carboxylate Traditional Name: 4-[(3-acetylphenyl)carbamoyl]piperazine-1-carboxylic acid tert-butyl ester Formula: C18H25N3O4 MolecularWeight: 347.4088

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC(=CC=C1)NC(=O)N2CCN(CC2)C(=O)OC(C)(C)C

Isomeric SMILES

CC(=O)C1=CC(=CC=C1)NC(=O)N2CCN(CC2)C(=O)OC(C)(C)C

InChI

InChI=1S/C18H25N3O4/c1-13(22)14-6-5-7-15(12-14)19-16(23)20-8-10-21(11-9-20)17(24)25-18(2,3)4/h5-7,12H,8-11H2,1-4H3,(H,19,23)