Basic information
- Standard SMILES
COc1ccc2c(c1)c(C(=O)N1CCC3(CC1)OC(=O)c1ccccc13)c(C)n2CCc1ccc(OC)c(OC)c1- InChIKey
UVMPBDKOZWOHEQ-UHFFFAOYSA-N- Molecular formula
- C33H34N2O6
- Average molar mass
- 554.6 g/mol
- Monoisotopic mass
- 554.24168681
Names & identifiers
- Preferred name
- 1'-({1-[2-(3,4-Dimethoxyphenyl)ethyl]-5-methoxy-2-methyl-1H-indol-3-yl}carbonyl)-3H-spiro[2-benzofuran-1,4'-piperidin]-3-one
- IUPAC
- 1'-[1-[2-(3,4-dimethoxyphenyl)ethyl]-5-methoxy-2-methylindole-3-carbonyl]spiro[2-benzofuran-3,4'-piperidine]-1-one
Names & synonyms
SCHEMBL4361715UVMPBDKOZWOHEQ-UHFFFAOYSA-N1'-({1-[2-(3,4-Dimethoxyphenyl)ethyl]-5-methoxy-2-methyl-1H-indol-3-yl}carbonyl)-3H-spiro[2-benzofuran-1,4'-piperidin]-3-one
Database identifiers
- PubChem CID
- 59657585
Properties
Computed structural properties
- XLogP
- 5.1
- Topological polar surface area
- 79.2 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 7
- Heavy atoms
- 41
- Formal charge
- 0
- Complexity
- 937
Related reactions
3 records
Linked notes
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