(2E)-2-cyano-3-[5-(2-methyl-4-nitrophenyl)furan-2-yl]-N-(2-methylphenyl)prop-2-enamide
Basic information
- CAS
5909-47-7- Standard SMILES
Cc1ccccc1NC(=O)/C(C#N)=C/c1ccc(-c2ccc([N+](=O)[O-])cc2C)o1- InChIKey
RJEWRQDFWPKCSR-FOWTUZBSSA-N- Molecular formula
- C22H17N3O4
- Average molar mass
- 387.4 g/mol
- Monoisotopic mass
- 387.12190603
Names & identifiers
- Preferred name
- (2E)-2-cyano-3-[5-(2-methyl-4-nitrophenyl)furan-2-yl]-N-(2-methylphenyl)prop-2-enamide
- IUPAC
- (E)-2-cyano-3-[5-(2-methyl-4-nitrophenyl)furan-2-yl]-N-(2-methylphenyl)prop-2-enamide
Names & synonyms
5909-47-7STK179426(2E)-2-cyano-3-[5-(2-methyl-4-nitrophenyl)furan-2-yl]-N-(2-methylphenyl)prop-2-enamide2-cyano-3-[5-(2-methyl-4-nitrophenyl)-2-furyl]-N-(2-methylphenyl)acrylamideDTXSID20416684AKOS000323109(E)-2-cyano-3-[5-(2-methyl-4-nitrophenyl)furan-2-yl]-N-(2-methylphenyl)prop-2-enamide
Database identifiers
- CAS
5909-47-7- PubChem CID
- 5337328
- DTXSID
DTXSID20416684
Properties
Computed structural properties
- XLogP
- 5
- Topological polar surface area
- 112 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 4
- Heavy atoms
- 29
- Formal charge
- 0
- Complexity
- 692
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Related reactions
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Compound notes
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