8-{[2-(diethylamino)ethyl]amino}-9-oxo-9H-xanthen-2-yl 4-methylbenzene-1-sulfonate

Details

Stereochemistry	ACHIRAL
Molecular Formula	C26H28N2O5S
Molecular Weight	480.576
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of 8-{[2-(diethylamino)ethyl]amino}-9-oxo-9H-xanthen-2-yl 4-methylbenzene-1-sulfonate

Structure Search

SMILES

CCN(CC)CCNC1=C2C(=O)C3=C(OC2=CC=C1)C=CC(OS(=O)(=O)C4=CC=C(C)C=C4)=C3

InChI

InChIKey=CVZVASXGNOHCJR-UHFFFAOYSA-N

InChI=1S/C26H28N2O5S/c1-4-28(5-2)16-15-27-22-7-6-8-24-25(22)26(29)21-17-19(11-14-23(21)32-24)33-34(30,31)20-12-9-18(3)10-13-20/h6-14,17,27H,4-5,15-16H2,1-3H3

HIDE SMILES / InChI

Molecular Formula	C26H28N2O5S
Molecular Weight	480.576
Charge	0
Count

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

Approval Year

Substance Class	Chemical Created by `admin` on `Tue Apr 01 19:59:31 GMT 2025` Edited by `admin` on `Tue Apr 01 19:59:31 GMT 2025`
Record UNII	46TJ5VZX8Q
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

NSC-355186

Preferred Name

English

8-{[2-(diethylamino)ethyl]amino}-9-oxo-9H-xanthen-2-yl 4-methylbenzene-1-sulfonate

Systematic Name

English

9H-XANTHEN-9-ONE, 1-((2-(DIETHYLAMINO)ETHYL)AMINO)-7-(((4-METHYLPHENYL)SULFONYL)OXY)-

Systematic Name

English

1-[[2-(Diethylamino)ethyl]amino]-7-[[(4-methylphenyl)sulfonyl]oxy]-9H-xanthen-9-one

Systematic Name

English

Code System Code Type Description

NSC

355186