(E)-but-2-enedioic acid;N-cyclohexyl-7-methyl-6,6a,8,9,10,10a-hexahydro-4H-indolo[4,3-fg]quinoline-9-carboxamide
Basic information
- CAS
50798-40-8- Standard SMILES
CN1CC(C(=O)NC2CCCCC2)CC2c3cccc4[nH]cc(c34)CC21.O=C(O)/C=C/C(=O)O- InChIKey
ZEXLNDQHHZRBMV-WLHGVMLRSA-N- Molecular formula
- C26H33N3O5
- Average molar mass
- 467.6 g/mol
- Monoisotopic mass
- 467.24202116
Names & identifiers
- Preferred name
- (E)-but-2-enedioic acid;N-cyclohexyl-7-methyl-6,6a,8,9,10,10a-hexahydro-4H-indolo[4,3-fg]quinoline-9-carboxamide
- IUPAC
- (E)-but-2-enedioic acid;N-cyclohexyl-7-methyl-6,6a,8,9,10,10a-hexahydro-4H-indolo[4,3-fg]quinoline-9-carboxamide
Names & synonyms
50798-40-8NSC173087NSC-173087
Database identifiers
- CAS
50798-40-8- PubChem CID
- 6509746
Properties
Computed structural properties
- Topological polar surface area
- 123 Ų
- Hydrogen bond donors
- 4
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 4
- Heavy atoms
- 34
- Formal charge
- 0
- Complexity
- 650
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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