tert-butyl N-[4-[4-(2-chlorophenyl)piperazin-1-yl]carbonylphenyl]carbamate

Systemtic Name: tert-butyl N-[4-[4-(2-chlorophenyl)piperazin-1-yl]carbonylphenyl]carbamate Openeye Name: tert-butyl N-[4-[4-(2-chlorophenyl)piperazine-1-carbonyl]phenyl]carbamate CAS Name: N-[4-[[4-(2-chlorophenyl)-1-piperazinyl]-oxomethyl]phenyl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[4-[4-(2-chlorophenyl)piperazine-1-carbonyl]phenyl]carbamate Traditional Name: N-[4-[4-(2-chlorophenyl)piperazine-1-carbonyl]phenyl]carbamic acid tert-butyl ester Formula: C22H26ClN3O3 MolecularWeight: 415.91314

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NC1=CC=C(C=C1)C(=O)N2CCN(CC2)C3=CC=CC=C3Cl

Isomeric SMILES

CC(C)(C)OC(=O)NC1=CC=C(C=C1)C(=O)N2CCN(CC2)C3=CC=CC=C3Cl

InChI

InChI=1S/C22H26ClN3O3/c1-22(2,3)29-21(28)24-17-10-8-16(9-11-17)20(27)26-14-12-25(13-15-26)19-7-5-4-6-18(19)23/h4-11H,12-15H2,1-3H3,(H,24,28)