Basic information
- CAS
62504-55-6- Standard SMILES
CN1CCc2cc3c(c4c2C1C(O)c1ccccc1-4)OCO3.Cl- InChIKey
SMCWYRTZZQNLFM-UHFFFAOYSA-N- Molecular formula
- C18H18ClNO3
- Average molar mass
- 331.8 g/mol
- Monoisotopic mass
- 331.0975211
Overview
See also: Oliveroline (annotation moved to).
Names & identifiers
- Preferred name
- 5H-Benzo(g)-1,3-benzodioxolo(6,5,4-de)quinolin-8-ol, 6,7,7a,8-tetrahydro-7-methyl-, hydrochloride, (7aS-cis)-
- IUPAC
- 11-methyl-3,5-dioxa-11-azapentacyclo[10.7.1.02,6.08,20.014,19]icosa-1(20),2(6),7,14,16,18-hexaen-13-ol;hydrochloride
Names & synonyms
Oliveroline chlorhydrate62504-55-6UNII-2Y8ZBF5RC52Y8ZBF5RC5NSC287451NSC 2874515H-Benzo(g)-1,3-benzodioxolo(6,5,4-de)quinolin-8-ol, 6,7,7a,8-tetrahydro-7-methyl-, hydrochloride, (7aS-cis)-NSC-287451CHEMBL198615611-methyl-3,5-dioxa-11-azapentacyclo[10.7.1.02,6.08,20.014,19]icosa-1(20),2(6),7,14,16,18-hexaen-13-ol;hydrochlorideQ154253005H-Benzo[g]-1,3-benzodioxolo[6,5,4-de]quinolin-8-ol, 6,7,7a,8-tetrahydro-7-methyl-, hydrochloride
Database identifiers
- CAS
62504-55-6- PubChem CID
- 3085243
- ChEMBL
CHEMBL1986156
Properties
Computed structural properties
- Topological polar surface area
- 41.9 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 0
- Heavy atoms
- 23
- Formal charge
- 0
- Complexity
- 444
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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