4-tert-butyl-N-[3-chloranyl-4-[4-[(2-chlorophenyl)methyl]piperazin-1-yl]phenyl]benzamide

Systemtic Name: 4-tert-butyl-N-[3-chloranyl-4-[4-[(2-chlorophenyl)methyl]piperazin-1-yl]phenyl]benzamide Openeye Name: 4-tert-butyl-N-[3-chloro-4-[4-[(2-chlorophenyl)methyl]piperazin-1-yl]phenyl]benzamide CAS Name: 4-tert-butyl-N-[3-chloro-4-[4-[(2-chlorophenyl)methyl]-1-piperazinyl]phenyl]benzamide IUPAC Name: 4-tert-butyl-N-[3-chloro-4-[4-[(2-chlorophenyl)methyl]piperazin-1-yl]phenyl]benzamide Traditional Name: 4-tert-butyl-N-[3-chloro-4-[4-(2-chlorobenzyl)piperazino]phenyl]benzamide Formula: C28H31Cl2N3O MolecularWeight: 496.47124

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)C(=O)NC2=CC(=C(C=C2)N3CCN(CC3)CC4=CC=CC=C4Cl)Cl

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)C(=O)NC2=CC(=C(C=C2)N3CCN(CC3)CC4=CC=CC=C4Cl)Cl

InChI

InChI=1S/C28H31Cl2N3O/c1-28(2,3)22-10-8-20(9-11-22)27(34)31-23-12-13-26(25(30)18-23)33-16-14-32(15-17-33)19-21-6-4-5-7-24(21)29/h4-13,18H,14-17,19H2,1-3H3,(H,31,34)