Basic information
- Standard SMILES
COC(=O)CC1(C2CCc3cc(OC)c(OC)cc3C2Cc2ccc(OC)c(OC)c2)C=CC=CC1- InChIKey
GCYIIFMWMWWCQR-UHFFFAOYSA-N- Molecular formula
- C30H36O6
- Average molar mass
- 492.6 g/mol
Names & identifiers
- Preferred name
- 1-[(3,4-Dimethoxy-benzyl)-6,7-dimethoxy-1,2,3,4-tetrahydro-naphthalen-2-yl]-phenyl-acetic acid methyl ester
- IUPAC
- methyl 2-[1-[1-[(3,4-dimethoxyphenyl)methyl]-6,7-dimethoxy-1,2,3,4-tetrahydronaphthalen-2-yl]cyclohexa-2,4-dien-1-yl]acetate
Names & synonyms
SCHEMBL6381243GCYIIFMWMWWCQR-UHFFFAOYSA-N1-[(3,4-Dimethoxy-benzyl)-6,7-dimethoxy-1,2,3,4-tetrahydro-naphthalen-2-yl]-phenyl-acetic acid methyl ester
Database identifiers
- PubChem CID
- 69760125
Properties
Computed structural properties
- XLogP
- 6.2
- Topological polar surface area
- 63.2 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 10
- Heavy atoms
- 36
- Formal charge
- 0
- Complexity
- 779
Related reactions
2 records
Compound notes
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