tert-butyl 4-(3-benzamido-4-methyl-phenyl)carbonylpiperazine-1-carboxylate

Systemtic Name: tert-butyl 4-(3-benzamido-4-methyl-phenyl)carbonylpiperazine-1-carboxylate Openeye Name: tert-butyl 4-(3-benzamido-4-methyl-benzoyl)piperazine-1-carboxylate CAS Name: 4-[(3-benzamido-4-methylphenyl)-oxomethyl]-1-piperazinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-(3-benzamido-4-methylbenzoyl)piperazine-1-carboxylate Traditional Name: 4-(3-benzamido-4-methyl-benzoyl)piperazine-1-carboxylic acid tert-butyl ester Formula: C24H29N3O4 MolecularWeight: 423.50476

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)N2CCN(CC2)C(=O)OC(C)(C)C)NC(=O)C3=CC=CC=C3

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)N2CCN(CC2)C(=O)OC(C)(C)C)NC(=O)C3=CC=CC=C3

InChI

InChI=1S/C24H29N3O4/c1-17-10-11-19(16-20(17)25-21(28)18-8-6-5-7-9-18)22(29)26-12-14-27(15-13-26)23(30)31-24(2,3)4/h5-11,16H,12-15H2,1-4H3,(H,25,28)