Basic information
- CAS
100773-63-5- Standard SMILES
CC[N+](C)(CC)CCN(C(=O)c1ccc(N)cc1)c1ccccc1.[Br-]- InChIKey
FOIGSPSSZBCGFP-UHFFFAOYSA-N- Molecular formula
- C20H28BrN3O
- Average molar mass
- 406.4 g/mol
- Monoisotopic mass
- 405.14158
Names & identifiers
- Preferred name
- Ammonium, (2-(p-amino-N-phenylbenzamido)ethyl)diethylmethyl-, bromide
- IUPAC
- 2-(N-(4-aminobenzoyl)anilino)ethyl-diethyl-methylazanium bromide
Names & synonyms
100773-63-5(2-(p-Amino-N-phenylbenzamido)ethyl)diethylmethylammonium bromideAMMONIUM, (2-(p-AMINO-N-PHENYLBENZAMIDO)ETHYL)DIETHYLMETHYL-, BROMIDERefChem:3187712-[(4-aminobenzoyl)(phenyl)amino]-n,n-diethyl-n-methylethanaminium bromide2-(N-(4-aminobenzoyl)anilino)ethyl-diethyl-methylazanium;bromide
Database identifiers
- CAS
100773-63-5- PubChem CID
- 58005
Properties
Computed structural properties
- Topological polar surface area
- 46.3 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 7
- Heavy atoms
- 25
- Formal charge
- 0
- Complexity
- 380
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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