Ammonium, (4-carboxy-3-hydroxycarbanilinomethyl)diethylmethyl-, iodide, methyl ester
Basic information
- CAS
13087-46-2- Standard SMILES
CC[N+](C)(CC)CC(=O)Nc1ccc(C(=O)OC)c(O)c1.[I-]- InChIKey
HDVHRPXDCVFXGL-UHFFFAOYSA-N- Molecular formula
- C15H23IN2O4
- Average molar mass
- 422.26 g/mol
- Monoisotopic mass
- 422.07025
Names & identifiers
- Preferred name
- Ammonium, (4-carboxy-3-hydroxycarbanilinomethyl)diethylmethyl-, iodide, methyl ester
- IUPAC
- diethyl-[2-(3-hydroxy-4-methoxycarbonylanilino)-2-oxoethyl]-methylazanium iodide
Names & synonyms
Methyl 4-(2-(diethylamino)acetylamino)salicylate, methiodide13087-46-2Salicylic acid, 4-(2-(diethylamino)acetamido)-, methyl ester, methiodideAmmonium, (4-carboxy-3-hydroxycarbanilinomethyl)diethylmethyl-, iodide, methyl esterRefChem:318912
Database identifiers
- CAS
13087-46-2- PubChem CID
- 25692
Properties
Computed structural properties
- Topological polar surface area
- 75.6 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 7
- Heavy atoms
- 22
- Formal charge
- 0
- Complexity
- 369
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Compound notes
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