7-Chloro-2-[2-(diethylamino)ethyl]-2,3-dihydro-4-methylpyrido[3,2-f][1,4]-oxazepin-5(4H)-one oxalate

HCID 13726598
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Basic information

Standard SMILES
CCN(CC)CCC1CN(C)C(=O)c2cc(Cl)cnc2O1.O=C(O)C(=O)O
InChIKey
NYTPKAMMFDMAAV-UHFFFAOYSA-N
Molecular formula
C17H24ClN3O6
Average molar mass
401.8 g/mol

Names & identifiers

Preferred name
7-Chloro-2-[2-(diethylamino)ethyl]-2,3-dihydro-4-methylpyrido[3,2-f][1,4]-oxazepin-5(4H)-one oxalate
IUPAC
7-chloro-2-[2-(diethylamino)ethyl]-4-methyl-2,3-dihydropyrido[3,2-f][1,4]oxazepin-5-one;oxalic acid

Names & synonyms

SCHEMBL10563730NYTPKAMMFDMAAV-UHFFFAOYSA-N7-Chloro-2-[2-(diethylamino)ethyl]-2,3-dihydro-4-methylpyrido[3,2-f][1,4]-oxazepin-5(4H)-one oxalate

Database identifiers

PubChem CID
13726598

Properties

Computed structural properties

Topological polar surface area
120 Ų
Hydrogen bond donors
2
Hydrogen bond acceptors
8
Rotatable bonds
6
Heavy atoms
27

Related reactions

7 records
New reaction record

Linked notes

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7-Chloro-2-[2-(diethylamino)ethyl]-2,3-dihydro-4-methylpyrido[3,2-f][1,4]-oxazepin-5(4H)-one oxalate (HCID 13726598)｜Huagongshe