2-(1-adamantyl)-N-[4-[4-(4-chlorophenyl)carbonylpiperazin-1-yl]phenyl]ethanamide

Systemtic Name: 2-(1-adamantyl)-N-[4-[4-(4-chlorophenyl)carbonylpiperazin-1-yl]phenyl]ethanamide Openeye Name: 2-(1-adamantyl)-N-[4-[4-(4-chlorobenzoyl)piperazin-1-yl]phenyl]acetamide CAS Name: 2-(1-adamantyl)-N-[4-[4-[(4-chlorophenyl)-oxomethyl]-1-piperazinyl]phenyl]acetamide IUPAC Name: 2-(1-adamantyl)-N-[4-[4-(4-chlorobenzoyl)piperazin-1-yl]phenyl]acetamide Traditional Name: 2-(1-adamantyl)-N-[4-[4-(4-chlorobenzoyl)piperazino]phenyl]acetamide Formula: C29H34ClN3O2 MolecularWeight: 492.05216

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=C(C=C2)NC(=O)CC34CC5CC(C3)CC(C5)C4)C(=O)C6=CC=C(C=C6)Cl

Isomeric SMILES

C1CN(CCN1C2=CC=C(C=C2)NC(=O)CC34CC5CC(C3)CC(C5)C4)C(=O)C6=CC=C(C=C6)Cl

InChI

InChI=1S/C29H34ClN3O2/c30-24-3-1-23(2-4-24)28(35)33-11-9-32(10-12-33)26-7-5-25(6-8-26)31-27(34)19-29-16-20-13-21(17-29)15-22(14-20)18-29/h1-8,20-22H,9-19H2,(H,31,34)