ALUMINUM 2-(1,3-DIOXO-2,3-DIHYDRO-1H-INDEN-2-YL)QUINOLINE-8-SULFONATE

Details

Stereochemistry	ACHIRAL
Molecular Formula	3C18H10NO5S.Al
Molecular Weight	1084.004
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of ALUMINUM 2-(1,3-DIOXO-2,3-DIHYDRO-1H-INDEN-2-YL)QUINOLINE-8-SULFONATE

Structure Search

SMILES

[Al+3].[O-]S(=O)(=O)C1=C2N=C(C=CC2=CC=C1)C3C(=O)C4=C(C=CC=C4)C3=O.[O-]S(=O)(=O)C5=C6N=C(C=CC6=CC=C5)C7C(=O)C8=C(C=CC=C8)C7=O.[O-]S(=O)(=O)C9=C%10N=C(C=CC%10=CC=C9)C%11C(=O)C%12=C(C=CC=C%12)C%11=O

InChI

InChIKey=URCNDHZFYBRNPQ-UHFFFAOYSA-K

InChI=1S/3C18H11NO5S.Al/c3*20-17-11-5-1-2-6-12(11)18(21)15(17)13-9-8-10-4-3-7-14(16(10)19-13)25(22,23)24;/h3*1-9,15H,(H,22,23,24);/q;;;+3/p-3

HIDE SMILES / InChI

Molecular Formula	C18H10NO5S
Molecular Weight	352.341
Charge	-1
Count

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

Molecular Formula	Al
Molecular Weight	26.9815
Charge	3
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 `Sat Dec 16 15:42:19 GMT 2023` Edited by `admin` on `Sat Dec 16 15:42:19 GMT 2023`
Record UNII	0WA4WG6O5L
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

ALUMINUM 2-(1,3-DIOXO-2,3-DIHYDRO-1H-INDEN-2-YL)QUINOLINE-8-SULFONATE

Systematic Name

English

Code System Code Type Description

FDA UNII

0WA4WG6O5L

Created by admin on Sat Dec 16 15:42:19 GMT 2023 , Edited by admin on Sat Dec 16 15:42:19 GMT 2023

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PUBCHEM

146019304

Created by admin on Sat Dec 16 15:42:19 GMT 2023 , Edited by admin on Sat Dec 16 15:42:19 GMT 2023

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