4-(3,6-BIS(DIETHYLAMINO)-9H-XANTHEN-9-YL)BENZENE-1,3-DISULFONIC ACID

Details

Stereochemistry	ACHIRAL
Molecular Formula	C27H32N2O7S2
Molecular Weight	560.682
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of 4-(3,6-BIS(DIETHYLAMINO)-9H-XANTHEN-9-YL)BENZENE-1,3-DISULFONIC ACID

Structure Search

SMILES

CCN(CC)C1=CC2=C(C=C1)C(C3=CC=C(C=C3S(O)(=O)=O)S(O)(=O)=O)C4=C(O2)C=C(C=C4)N(CC)CC

InChI

InChIKey=ZMQJXVGDHQCYTO-UHFFFAOYSA-N

InChI=1S/C27H32N2O7S2/c1-5-28(6-2)18-9-12-21-24(15-18)36-25-16-19(29(7-3)8-4)10-13-22(25)27(21)23-14-11-20(37(30,31)32)17-26(23)38(33,34)35/h9-17,27H,5-8H2,1-4H3,(H,30,31,32)(H,33,34,35)

HIDE SMILES / InChI

Molecular Formula	C27H32N2O7S2
Molecular Weight	560.682
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 20:24:43 GMT 2025` Edited by `admin` on `Tue Apr 01 20:24:43 GMT 2025`
Record UNII	B8TUJ8S9VT
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

4-(3,6-BIS(DIETHYLAMINO)-9H-XANTHEN-9-YL)BENZENE-1,3-DISULFONIC ACID

Systematic Name

English

1,3-BENZENEDISULFONIC ACID, 4-(3,6-BIS(DIETHYLAMINO)-9H-XANTHEN-9-YL)-

Preferred Name

English

1,3-BENZENEDISULPHONIC ACID, 4-(3,6-BIS(DIETHYLAMINO)-9H-XANTHEN-9-YL)-

Systematic Name

English

4-(3,6-BIS(DIETHYLAMINO)-9H-XANTHEN-9-YL)BENZENE-1,3-DISULPHONIC ACID

Systematic Name

English

4-(3,6-BIS(DIETHYLAMINO)-9H-XANTHEN-9-YL)-1,3-BENZENEDISULFONIC ACID

Systematic Name

English

Code System Code Type Description

FDA UNII

B8TUJ8S9VT