tert-butyl N-[[4-[4-(4-chlorophenyl)carbonylpiperazin-1-yl]carbonylphenyl]methyl]carbamate

Systemtic Name: tert-butyl N-[[4-[4-(4-chlorophenyl)carbonylpiperazin-1-yl]carbonylphenyl]methyl]carbamate Openeye Name: tert-butyl N-[[4-[4-(4-chlorobenzoyl)piperazine-1-carbonyl]phenyl]methyl]carbamate CAS Name: N-[[4-[[4-[(4-chlorophenyl)-oxomethyl]-1-piperazinyl]-oxomethyl]phenyl]methyl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[[4-[4-(4-chlorobenzoyl)piperazine-1-carbonyl]phenyl]methyl]carbamate Traditional Name: N-[4-[4-(4-chlorobenzoyl)piperazine-1-carbonyl]benzyl]carbamic acid tert-butyl ester Formula: C24H28ClN3O4 MolecularWeight: 457.94982

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NCC1=CC=C(C=C1)C(=O)N2CCN(CC2)C(=O)C3=CC=C(C=C3)Cl

Isomeric SMILES

CC(C)(C)OC(=O)NCC1=CC=C(C=C1)C(=O)N2CCN(CC2)C(=O)C3=CC=C(C=C3)Cl

InChI

InChI=1S/C24H28ClN3O4/c1-24(2,3)32-23(31)26-16-17-4-6-18(7-5-17)21(29)27-12-14-28(15-13-27)22(30)19-8-10-20(25)11-9-19/h4-11H,12-16H2,1-3H3,(H,26,31)