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Details

Stereochemistry ACHIRAL
Molecular Formula C32H31N2O3
Molecular Weight 491.6001
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 1

SHOW SMILES / InChI
Structure of Rhodamine 101 ion(1+)

SMILES

OC(=O)C1=C(C=CC=C1)C2=C3C=C4CCCN5CCCC(C3=[O+]C6=C7CCCN8CCCC(C=C26)=C78)=C45

InChI

InChIKey=MUSLHCJRTRQOSP-UHFFFAOYSA-O
InChI=1S/C32H30N2O3/c35-32(36)22-10-2-1-9-21(22)27-25-17-19-7-3-13-33-15-5-11-23(28(19)33)30(25)37-31-24-12-6-16-34-14-4-8-20(29(24)34)18-26(27)31/h1-2,9-10,17-18H,3-8,11-16H2/p+1

HIDE SMILES / InChI

Molecular Formula C32H31N2O3
Molecular Weight 491.6001
Charge 1
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 Wed Apr 02 18:49:55 GMT 2025
Edited
by admin
on Wed Apr 02 18:49:55 GMT 2025
Record UNII
EQ7W29R4HU
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
1H,5H,11H,15H-Xantheno[2,3,4-ij:5,6,7-i'j?]diquinolizin-18-ium, 9-(2-carboxyphenyl)-2,3,6,7,12,13,16,17-octahydro-
Preferred Name English
Rhodamine 101 ion(1+)
Common Name English
9-(2-Carboxyphenyl)-2,3,6,7,12,13,16,17-octahydro-1H,5H,11H,15H-xantheno[2,3,4-ij:5,6,7-i'j?]diquinolizin-18-ium
Systematic Name English
Code System Code Type Description
CAS
72102-90-0
Created by admin on Wed Apr 02 18:49:55 GMT 2025 , Edited by admin on Wed Apr 02 18:49:55 GMT 2025
PRIMARY
PUBCHEM
153491
Created by admin on Wed Apr 02 18:49:55 GMT 2025 , Edited by admin on Wed Apr 02 18:49:55 GMT 2025
PRIMARY
FDA UNII
EQ7W29R4HU
Created by admin on Wed Apr 02 18:49:55 GMT 2025 , Edited by admin on Wed Apr 02 18:49:55 GMT 2025
PRIMARY
Related Record Type Details
IONIC MOIETY
SALT/SOLVATE -> PARENT