1H-Indole, 4-(1-propyl-3-piperidinyl)-, (E)-2-butenedioate (2:1)
Basic information
- CAS
83363-37-5- Standard SMILES
CCCN1CCCC(c2cccc3[nH]ccc23)C1.CCCN1CCCC(c2cccc3[nH]ccc23)C1.O=C(O)/C=C/C(=O)O- InChIKey
FUBGBWYWYVDEOI-WXXKFALUSA-N- Molecular formula
- C36H48N4O4
- Average molar mass
- 600.8 g/mol
- Monoisotopic mass
- 600.36755603
Names & identifiers
- Preferred name
- 1H-Indole, 4-(1-propyl-3-piperidinyl)-, (E)-2-butenedioate (2:1)
- IUPAC
- (E)-but-2-enedioic acid;bis(4-(1-propylpiperidin-3-yl)-1H-indole)
Names & synonyms
1H-Indole, 4-(1-propyl-3-piperidinyl)-, (E)-2-butenedioate (2:1)RefChem:105816883363-37-54-(1-Propyl-3-piperidinyl)-1H-indole (E)-2-butenedioate (2:1)4-(1-Propylpiperidin-3-yl)-1H-indole fumarate (2:1)
Database identifiers
- CAS
83363-37-5- PubChem CID
- 6448165
Properties
Computed structural properties
- Topological polar surface area
- 113 Ų
- Hydrogen bond donors
- 4
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 8
- Heavy atoms
- 44
- Formal charge
- 0
- Complexity
- 385
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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