Basic information
- CAS
3411-52-7- Standard SMILES
CC(C)N1CC(CCN2CCOCC2)C(c2ccccc2)(C2CCCC2)C1=O.O=C(O)/C=C\C(=O)O- InChIKey
KYPOKQWXWAPCFT-BTJKTKAUSA-N- Molecular formula
- C28H40N2O6
- Average molar mass
- 500.6 g/mol
- Monoisotopic mass
- 500.288637
Names & identifiers
- Preferred name
- (Z)-but-2-enedioic acid;3-cyclopentyl-4-(2-morpholin-4-ylethyl)-3-phenyl-1-propan-2-ylpyrrolidin-2-one
- IUPAC
- (Z)-but-2-enedioic acid;3-cyclopentyl-4-(2-morpholin-4-ylethyl)-3-phenyl-1-propan-2-ylpyrrolidin-2-one
Names & synonyms
NSC3102223411-52-7NSC-310222
Database identifiers
- CAS
3411-52-7- PubChem CID
- 5384151
Properties
Computed structural properties
- Topological polar surface area
- 107 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 8
- Heavy atoms
- 36
- Formal charge
- 0
- Complexity
- 638
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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