Didesmethyl Erlotinib Hydrochloride Salt

Details

Stereochemistry	ACHIRAL
Molecular Formula	C20H19N3O4.ClH
Molecular Weight	401.844
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of Didesmethyl Erlotinib Hydrochloride Salt

Structure Search

SMILES

Cl.OCCOC1=CC2=C(C=C1OCCO)C(NC3=CC(=CC=C3)C#C)=NC=N2

InChI

InChIKey=CUXTVYBENQCZOP-UHFFFAOYSA-N

InChI=1S/C20H19N3O4.ClH/c1-2-14-4-3-5-15(10-14)23-20-16-11-18(26-8-6-24)19(27-9-7-25)12-17(16)21-13-22-20;/h1,3-5,10-13,24-25H,6-9H2,(H,21,22,23);1H

HIDE SMILES / InChI

Molecular Formula	ClH
Molecular Weight	36.461
Charge	0
Count

Stereochemistry	ACHIRAL
Additional Stereochemistry	No
Defined Stereocenters	0 / 0
E/Z Centers	0
Optical Activity	NONE

Molecular Formula	C20H19N3O4
Molecular Weight	365.3826
Charge	0
Count

Stereochemistry	ACHIRAL
Additional Stereochemistry	No
Defined Stereocenters	0 / 0
E/Z Centers	0
Optical Activity	NONE

Approval Year

Patents

Substance Class	Chemical Created by `admin` on `Sat Dec 16 19:53:38 GMT 2023` Edited by `admin` on `Sat Dec 16 19:53:38 GMT 2023`
Record UNII	6PK6W9S7J8
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

Didesmethyl Erlotinib Hydrochloride Salt

Common Name

English

Ethanol, 2,2′-[[4-[(3-ethynylphenyl)amino]-6,7-quinazolinediyl]bis(oxy)]bis-, monohydrochloride

Systematic Name

English

Ethanol, 2-[[4-[(3-ethynylphenyl)amino]-6-(2-hydroxyethoxy)-7-quinazolinyl]oxy]-, hydrochloride

Systematic Name

English

Ethanol, 2-[[4-[(3-ethynylphenyl)amino]-6-(2-hydroxyethoxy)-7-quinazolinyl]oxy]-, hydrochloride (1:1)

Systematic Name

English

Code System Code Type Description

FDA UNII

6PK6W9S7J8

Created by admin on Sat Dec 16 19:53:38 GMT 2023 , Edited by admin on Sat Dec 16 19:53:38 GMT 2023

PRIMARY

PUBCHEM

18925039

Created by admin on Sat Dec 16 19:53:38 GMT 2023 , Edited by admin on Sat Dec 16 19:53:38 GMT 2023

PRIMARY

CAS

183320-12-9

Created by admin on Sat Dec 16 19:53:38 GMT 2023 , Edited by admin on Sat Dec 16 19:53:38 GMT 2023

PRIMARY

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