3-azido-2,3,4,5-tetrahydro-2-oxo-1H-1-benzazepine-1-propanoic acid, ethyl ester

HCID 86749790
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Basic information

Standard SMILES
CCOC(=O)CCN1C(=O)C(N=[N+]=[N-])CCc2ccccc21
InChIKey
AVKLUFKBZUUHEC-UHFFFAOYSA-N
Molecular formula
C15H18N4O3
Average molar mass
302.33 g/mol

Names & identifiers

Preferred name
3-azido-2,3,4,5-tetrahydro-2-oxo-1H-1-benzazepine-1-propanoic acid, ethyl ester
IUPAC
ethyl 3-(3-azido-2-oxo-4,5-dihydro-3H-1-benzazepin-1-yl)propanoate

Names & synonyms

AVKLUFKBZUUHEC-UHFFFAOYSA-N3-azido-2,3,4,5-tetrahydro-2-oxo-1H-1-benzazepine-1-propanoic acid, ethyl ester

Database identifiers

PubChem CID
86749790

Properties

Computed structural properties

XLogP
3
Topological polar surface area
61 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
5
Rotatable bonds
6
Heavy atoms
22

Related reactions

4 records
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Linked notes

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