SODIUM 3-(N-(3-(DIMETHYLAMINO)PROPYL)HEPTADECAFLUOROOCTANESULFONAMIDO)-2-HYDROXYPROPANE-1-SULFONATE

Details

Stereochemistry	RACEMIC
Molecular Formula	C16H18F17N2O6S2.Na
Molecular Weight	744.417
Optical Activity	( + / - )
Defined Stereocenters	0 / 1
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of SODIUM 3-(N-(3-(DIMETHYLAMINO)PROPYL)HEPTADECAFLUOROOCTANESULFONAMIDO)-2-HYDROXYPROPANE-1-SULFONATE

Structure Search

SMILES

[Na+].CN(C)CCCN(CC(O)CS([O-])(=O)=O)S(=O)(=O)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)F

InChI

InChIKey=WALPFEROPZNJCB-UHFFFAOYSA-M

InChI=1S/C16H19F17N2O6S2.Na/c1-34(2)4-3-5-35(6-8(36)7-42(37,38)39)43(40,41)16(32,33)14(27,28)12(23,24)10(19,20)9(17,18)11(21,22)13(25,26)15(29,30)31;/h8,36H,3-7H2,1-2H3,(H,37,38,39);/q;+1/p-1

HIDE SMILES / InChI

Molecular Formula	Na
Molecular Weight	22.9898
Charge	1
Count

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

Molecular Formula	C16H18F17N2O6S2
Molecular Weight	721.427
Charge	-1
Count

Stereochemistry	RACEMIC
Additional Stereochemistry	No
Defined Stereocenters	0 / 1
E/Z Centers	0
Optical Activity	( + / - )

Approval Year

Substance Class	Chemical Created by `admin` on `Sat Dec 16 11:19:15 GMT 2023` Edited by `admin` on `Sat Dec 16 11:19:15 GMT 2023`
Record UNII	958F778B42
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

SODIUM 3-(N-(3-(DIMETHYLAMINO)PROPYL)HEPTADECAFLUOROOCTANESULFONAMIDO)-2-HYDROXYPROPANE-1-SULFONATE

Common Name

English

1-PROPANESULFONIC ACID, 3-((3-(DIMETHYLAMINO)PROPYL)((1,1,2,2,3,3,4,4,5,5,6,6,7,7,8,8,8-HEPTADECAFLUOROOCTYL)SULFONYL)AMINO)-2-HYDROXY-, SODIUM SALT (1:1)

Systematic Name

English

1-PROPANESULFONIC ACID, 3-((3-(DIMETHYLAMINO)PROPYL)((HEPTADECAFLUOROOCTYL)SULFONYL)AMINO)-2-HYDROXY-, MONOSODIUM SALT

Common Name

English

Code System Code Type Description

FDA UNII

958F778B42