Icotinib
CAS Registry Number®
610798-31-7
CAS Name
IcotinibMolecular Formula
C22H21N3O4Molecular Mass
391.42Cite this Page
Icotinib. CAS Common Chemistry. CAS, a division of the American Chemical Society, n.d. http://commonchemistry.cas.org/detail?cas_rn=610798-31-7 (retrieved ) (CAS RN: 610798-31-7). Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).Other Names and Identifiers
InChI
InChI=1S/C22H21N3O4/c1-2-16-4-3-5-17(12-16)25-22-18-13-20-21(14-19(18)23-15-24-22)29-11-9-27-7-6-26-8-10-28-20/h1,3-5,12-15H,6-11H2,(H,23,24,25)
InChIKey
InChIKey=QQLKULDARVNMAL-UHFFFAOYSA-N
SMILES
N(C=1C2=C(C=C3C(=C2)OCCOCCOCCO3)N=CN1)C4=CC(C#C)=CC=C4
Canonical SMILES
C#CC1=CC=CC(=C1)NC=2N=CN=C3C=C4OCCOCCOCCOC4=CC32
Other Names for this Substance
- [1,4,7,10]Tetraoxacyclododecino[2,3-g]quinazolin-4-amine, N-(3-ethynylphenyl)-7,8,10,11,13,14-hexahydro-
- N-(3-Ethynylphenyl)-7,8,10,11,13,14-hexahydro[1,4,7,10]tetraoxacyclododecino[2,3-g]quinazolin-4-amine
- Icotinib
- BPI 2009H
Deleted or Replaced CAS Registry Numbers
1640118-92-8