Home > Compound List > Compound details
183320-51-6 molecular structure
click picture or here to close

2-({4-[(3-ethynylphenyl)amino]-7-(2-methoxyethoxy)quinazolin-6-yl}oxy)ethan-1-ol hydrochloride

ChemBase ID: 72897
Molecular Formular: C21H22ClN3O4
Molecular Mass: 415.87008
Monoisotopic Mass: 415.12988388
SMILES and InChIs

SMILES:
c1c(cccc1Nc1ncnc2c1cc(c(c2)OCCOC)OCCO)C#C.Cl
Canonical SMILES:
OCCOc1cc2c(ncnc2cc1OCCOC)Nc1cccc(c1)C#C.Cl
InChI:
InChI=1S/C21H21N3O4.ClH/c1-3-15-5-4-6-16(11-15)24-21-17-12-19(27-8-7-25)20(28-10-9-26-2)13-18(17)22-14-23-21;/h1,4-6,11-14,25H,7-10H2,2H3,(H,22,23,24);1H
InChIKey:
BUOXOWNQZVIETJ-UHFFFAOYSA-N

Cite this record

CBID:72897 http://www.chembase.cn/molecule-72897.html

Collapse All Expand All

NAMES AND DATABASE IDS

DATA SOURCES

CALCULATED PROPERTIES

PROPERTIES

DETAILS

PATENTS

INTERNET