Basic information
- Standard SMILES
CN(CC=CCl)Cc1cccc2ccccc12.O=C(O)C(=O)O- InChIKey
HPFAOROLZHOJHC-UHFFFAOYSA-N- Molecular formula
- C17H18ClNO4
- Average molar mass
- 335.8 g/mol
Names & identifiers
- Preferred name
- N-(3-chloro-2-propenyl)-N-methyl-1-naphthalene-methanamine oxalate
- IUPAC
- 3-chloro-N-methyl-N-(naphthalen-1-ylmethyl)prop-2-en-1-amine;oxalic acid
Names & synonyms
SCHEMBL5380707HPFAOROLZHOJHC-UHFFFAOYSA-NN-(3-chloro -2-propenyl)-N-methyl-1-naphthalene-methanamine oxalateN-(3-chloro-2-propenyl)-N-methyl-1-naphthalene-methanamine oxalate
Database identifiers
- PubChem CID
- 86604117
Properties
Computed structural properties
- Topological polar surface area
- 77.8 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 5
- Heavy atoms
- 23
- Formal charge
- 0
- Complexity
- 323
Related reactions
1 records
Compound notes
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