1,1',3,3,3',3'-Hexamethylindodicarbocyanine iodide

Details

Stereochemistry	ACHIRAL
Molecular Formula	C27H31N2.I
Molecular Weight	510.4529
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	3
Charge	0

SHOW SMILES / InChI

Structure of 1,1',3,3,3',3'-Hexamethylindodicarbocyanine iodide

Structure Search

SMILES

[I-].CN1C(=CC=CC=CC2=[N+](C)C3=CC=CC=C3C2(C)C)C(C)(C)C4=CC=CC=C14

InChI

InChIKey=UANMYOBKUNUUTR-UHFFFAOYSA-M

InChI=1S/C27H31N2.HI/c1-26(2)20-14-10-12-16-22(20)28(5)24(26)18-8-7-9-19-25-27(3,4)21-15-11-13-17-23(21)29(25)6;/h7-19H,1-6H3;1H/q+1;/p-1

HIDE SMILES / InChI

Molecular Formula	C27H31N2
Molecular Weight	383.5484
Charge	1
Count

Stereochemistry	ACHIRAL
Additional Stereochemistry	No
Defined Stereocenters	0 / 0
E/Z Centers	3
Optical Activity	NONE

Molecular Formula	I
Molecular Weight	126.9045
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 `Sat Dec 16 12:49:04 GMT 2023` Edited by `admin` on `Sat Dec 16 12:49:04 GMT 2023`
Record UNII	2H8U2C7F2N
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

1,1',3,3,3',3'-Hexamethylindodicarbocyanine iodide

Common Name

English

3H-INDOLIUM, 2-(5-(1,3-DIHYDRO-1,3,3-TRIMETHYL-2H-INDOL-2-YLIDENE)-1,3-PENTADIEN-1-YL)-1,3,3-TRIMETHYL-, IODIDE (1:1)

Systematic Name

English

3H-Indolium, 2-[5-(1,3-dihydro-1,3,3-trimethyl-2H-indol-2-ylidene)-1,3-pentadienyl]-1,3,3-trimethyl-, iodide

Systematic Name

English

3H-Indolium, 2-[5-(1,3-dihydro-1,3,3-trimethyl-2H-indol-2-ylidene)-1,3-pentadienyl]-1,3,3-trimethyl-, iodid

Systematic Name

English

3H-Indolium, 2-[(1E,3E,5E)-5-(1,3-dihydro-1,3,3-trimethyl-2H-indol-2-ylidene)-1,3-pentadien-1-yl]-1,3,3-trimethyl-, iodide (1:1)

Systematic Name

English

1,3,3-trimethyl-2-[(1E,3E,5E)-5-(1,3,3-trimethylindol-2-ylidene)penta-1,3-dienyl]indol-1-ium iodide

Systematic Name

English

Hexacyanine 2

Common Name

English

HIDC iodide

Common Name

English

SNC-6

Code

English

NK-529

Code

English

3H-Indolium, 2-[5-(1,3-dihydro-1,3,3-trimethyl-2H-indol-2-ylidene)-1,3-pentadienyl]-1,3,3-trimethyl-, iodide, (all-E)-

Common Name

English

Code System Code Type Description

PUBCHEM

119007