2-(3-bromanyl-1-adamantyl)-1-[4-(2-phenoxyethyl)piperazin-1-yl]ethanone

Systemtic Name: 2-(3-bromanyl-1-adamantyl)-1-[4-(2-phenoxyethyl)piperazin-1-yl]ethanone Openeye Name: 2-(3-bromo-1-adamantyl)-1-[4-(2-phenoxyethyl)piperazin-1-yl]ethanone CAS Name: 2-(3-bromo-1-adamantyl)-1-[4-(2-phenoxyethyl)-1-piperazinyl]ethanone IUPAC Name: 2-(3-bromo-1-adamantyl)-1-[4-(2-phenoxyethyl)piperazin-1-yl]ethanone Traditional Name: 2-(3-bromo-1-adamantyl)-1-[4-(2-phenoxyethyl)piperazino]ethanone Formula: C24H33BrN2O2 MolecularWeight: 461.43502

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CCOC2=CC=CC=C2)C(=O)CC34CC5CC(C3)CC(C5)(C4)Br

Isomeric SMILES

C1CN(CCN1CCOC2=CC=CC=C2)C(=O)CC34CC5CC(C3)CC(C5)(C4)Br

InChI

InChI=1S/C24H33BrN2O2/c25-24-15-19-12-20(16-24)14-23(13-19,18-24)17-22(28)27-8-6-26(7-9-27)10-11-29-21-4-2-1-3-5-21/h1-5,19-20H,6-18H2