3-Acetylamino-6-chloro-1-(ethoxycarbonyl)-2-(2-naphthoyl)indole

HCID 18367756
NotesReactions
Substructure searchFind similar structures

Basic information

Standard SMILES
CCOC(=O)n1c(C(=O)c2ccc3ccccc3c2)c(NC(C)=O)c2ccc(Cl)cc21
InChIKey
LXIBDRLPBAXDPZ-UHFFFAOYSA-N
Molecular formula
C24H19ClN2O4
Average molar mass
434.9 g/mol
Monoisotopic mass
434.1033348

Names & identifiers

Preferred name
3-Acetylamino-6-chloro-1-(ethoxycarbonyl)-2-(2-naphthoyl)indole
IUPAC
ethyl 3-acetamido-6-chloro-2-(naphthalene-2-carbonyl)indole-1-carboxylate

Names & synonyms

SCHEMBL7504453LXIBDRLPBAXDPZ-UHFFFAOYSA-N3-Acetylamino-6-chloro-1-(ethoxycarbonyl)-2-(2-naphthoyl)indole

Database identifiers

PubChem CID
18367756

Properties

Computed structural properties

XLogP
5.9
Topological polar surface area
77.4 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
4
Rotatable bonds
5
Heavy atoms
31

Related reactions

2 records
New reaction record

Compound notes

Loading…