Piperazine, 1-(4-(alpha-(p-chlorophenyl)benzyloxy)butyl)-4-(o-tolyl)-, oxalate

HCID 91027

Notes Reactions

Substructure search Find similar structures

Basic information

CAS: 23904-93-0
Standard SMILES: Cc1ccccc1N1CCN(CCCCOC(c2ccccc2)c2ccc(Cl)cc2)CC1.O=C(O)C(=O)O
InChIKey: UGXWMPTVDJFREO-UHFFFAOYSA-N
Molecular formula: C30H35ClN2O5
Average molar mass: 539.1 g/mol
Monoisotopic mass: 538.2234499

Names & identifiers

Preferred name: Piperazine, 1-(4-(alpha-(p-chlorophenyl)benzyloxy)butyl)-4-(o-tolyl)-, oxalate
IUPAC: 1-[4-[(4-chlorophenyl)-phenylmethoxy]butyl]-4-(2-methylphenyl)piperazine;oxalic acid

Names & synonyms

23904-93-01-(4-(alpha-(p-Chlorophenyl)benzyloxy)butyl)-4-(o-tolyl)piperazine oxalatePiperazine, 1-(4-(alpha-(p-chlorophenyl)benzyloxy)butyl)-4-(o-tolyl)-, oxalateRefChem:372333DTXSID40946716Oxalic acid--1-{4-[(4-chlorophenyl)(phenyl)methoxy]butyl}-4-(2-methylphenyl)piperazine (1/1)

Database identifiers

CAS: 23904-93-0
PubChem CID: 91027
DTXSID: DTXSID40946716

Properties

Computed structural properties

Topological polar surface area: 90.3 Å²
Hydrogen bond donors: 2
Hydrogen bond acceptors: 7
Rotatable bonds: 10
Heavy atoms: 38
Formal charge: 0
Complexity: 581

Related reactions

0 records

New reaction record

No reaction records under the current filter.

Compound notes

Loading…