N-(2-ETHYLHEXYL)-1-ISOPROPYL-4-METHYLBICLYCLO(2:2:2)OCT-5-ENE-2,3-DICARBOXIMIDE, EXO-

Details

Stereochemistry	MIXED
Molecular Formula	C22H35NO2
Molecular Weight	345.5188
Optical Activity	UNSPECIFIED
Defined Stereocenters	4 / 5
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of N-(2-ETHYLHEXYL)-1-ISOPROPYL-4-METHYLBICLYCLO(2:2:2)OCT-5-ENE-2,3-DICARBOXIMIDE, EXO-

Structure Search

SMILES

[H][C@]12C(=O)N(CC(CC)CCCC)C(=O)[C@@]1([H])[C@]3(CC[C@]2(C)C=C3)C(C)C

InChI

InChIKey=MVKYQJHRHHQPDM-RSKJECSZSA-N

InChI=1S/C22H35NO2/c1-6-8-9-16(7-2)14-23-19(24)17-18(20(23)25)22(15(3)4)12-10-21(17,5)11-13-22/h10,12,15-18H,6-9,11,13-14H2,1-5H3/t16?,17-,18+,21+,22-/m1/s1

HIDE SMILES / InChI

Molecular Formula	C22H35NO2
Molecular Weight	345.5188
Charge	0
Count

Stereochemistry	EPIMERIC
Additional Stereochemistry	No
Defined Stereocenters	4 / 5
E/Z Centers	0
Optical Activity	UNSPECIFIED

Approval Year

Substance Class	Chemical Created by `admin` on `Sat Dec 16 09:06:03 GMT 2023` Edited by `admin` on `Sat Dec 16 09:06:03 GMT 2023`
Record UNII	TE451MG8C3
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

N-(2-ETHYLHEXYL)-1-ISOPROPYL-4-METHYLBICLYCLO(2:2:2)OCT-5-ENE-2,3-DICARBOXIMIDE, EXO-

Common Name

English

4,7-ETHANO-1H-ISOINDOLE-1,3(2H)-DIONE, 2-(2-ETHYLHEXYL)-3A,4,7,7A-TETRAHYDRO-4-METHYL-7-(1-METHYLETHYL)-, (3AR,4S,7S,7AS)-REL-

Systematic Name

English

Code System Code Type Description

FDA UNII

TE451MG8C3

Created by admin on Sat Dec 16 09:06:03 GMT 2023 , Edited by admin on Sat Dec 16 09:06:03 GMT 2023

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CAS

298203-36-8

Created by admin on Sat Dec 16 09:06:03 GMT 2023 , Edited by admin on Sat Dec 16 09:06:03 GMT 2023

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PUBCHEM

126961368

Created by admin on Sat Dec 16 09:06:03 GMT 2023 , Edited by admin on Sat Dec 16 09:06:03 GMT 2023

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