Ethyl 2-methyl-4,9-dioxo-1-phenylbenzo[f]indole-3-carboxylate
Basic information
- CAS
70959-90-9- Standard SMILES
CCOC(=O)c1c2c(n(-c3ccccc3)c1C)C(=O)c1ccccc1C2=O- InChIKey
HELAGDGXAKCYPU-UHFFFAOYSA-N- Molecular formula
- C22H17NO4
- Average molar mass
- 359.4 g/mol
- Monoisotopic mass
- 359.11575802
Names & identifiers
- Preferred name
- Ethyl 2-methyl-4,9-dioxo-1-phenylbenzo[f]indole-3-carboxylate
- IUPAC
- ethyl 2-methyl-4,9-dioxo-1-phenylbenzo[f]indole-3-carboxylate
Names & synonyms
NSC31613070959-90-9ethyl 2-methyl-4,9-dioxo-1-phenylbenzo[f]indole-3-carboxylateOprea1_559791DTXSID10317474NSC-316130ethyl 2-methyl-4,9-dioxo-1-phenyl-benzo[f]indole-3-carboxylate1H-Benz[f]indole-3-carboxylic acid, 4,9-dihydro-2-methyl-4,9-dioxo-1-phenyl-, ethyl esterEthyl 2-methyl-4,9-dioxo-1-phenyl-4,9-dihydro-1H-benzo[f]indole-3-carboxylate
Database identifiers
- CAS
70959-90-9- PubChem CID
- 330126
- DTXSID
DTXSID10317474- Nikkaji
- J1.808.706E
Properties
Computed structural properties
- XLogP
- 4.2
- Topological polar surface area
- 65.4 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 4
- Heavy atoms
- 27
- Formal charge
- 0
- Complexity
- 611
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Related reactions
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Compound notes
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