Piperazine, 1-nitroso-4-((2-(phenylmethyl)phenyl)methyl)-, (Z)-2-butenedioate (1:1)
Basic information
- CAS
37652-85-0- Standard SMILES
O=C(O)/C=C/C(=O)O.O=NN1CCN(Cc2ccccc2Cc2ccccc2)CC1- InChIKey
ZIPHNRZTVAODBN-WLHGVMLRSA-N- Molecular formula
- C22H25N3O5
- Average molar mass
- 411.5 g/mol
- Monoisotopic mass
- 411.17942091
Names & identifiers
- Preferred name
- Piperazine, 1-nitroso-4-((2-(phenylmethyl)phenyl)methyl)-, (Z)-2-butenedioate (1:1)
- IUPAC
- 1-[(2-benzylphenyl)methyl]-4-nitrosopiperazine;(E)-but-2-enedioic acid
Names & synonyms
37652-85-0RefChem:1096037Piperazine, 1-nitroso-4-((2-(phenylmethyl)phenyl)methyl)-, (Z)-2-butenedioate (1:1)1-(2-Benzylbenzyl)-4-nitrosopiperazine hydrogen maleate1-Nitroso-4-((2-(phenylmethyl)phenyl)methyl)piperazine maleatePiperazine, 1-nitroso-4-((2-(phenylmethyl)phenyl)methyl)-, (Z) -2-butenedioate (1:1)
Database identifiers
- CAS
37652-85-0- PubChem CID
- 6445604
Properties
Computed structural properties
- Topological polar surface area
- 111 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 8
- Rotatable bonds
- 6
- Heavy atoms
- 30
- Formal charge
- 0
- Complexity
- 454
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Compound notes
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