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Details

Stereochemistry ACHIRAL
Molecular Formula C26H30N2O7
Molecular Weight 482.5256
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of DIBUTYL 2-(ACETYLAMINO)-4,6-DIMETHYL-3-OXO-3H-PHENOXAZINE-1,9-DICARBOXYLATE

SMILES

CCCCOC(=O)C1=C2N=C3C(OC2=C(C)C=C1)=C(C)C(=O)C(NC(C)=O)=C3C(=O)OCCCC

InChI

InChIKey=KZAJHKQPWNTRHX-UHFFFAOYSA-N
InChI=1S/C26H30N2O7/c1-6-8-12-33-25(31)17-11-10-14(3)23-19(17)28-21-18(26(32)34-13-9-7-2)20(27-16(5)29)22(30)15(4)24(21)35-23/h10-11H,6-9,12-13H2,1-5H3,(H,27,29)

HIDE SMILES / InChI

Molecular Formula C26H30N2O7
Molecular Weight 482.5256
Charge 0
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 12:43:16 GMT 2023
Edited
by admin
on Sat Dec 16 12:43:16 GMT 2023
Record UNII
O7TS50A3ZX
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
DIBUTYL 2-(ACETYLAMINO)-4,6-DIMETHYL-3-OXO-3H-PHENOXAZINE-1,9-DICARBOXYLATE
Systematic Name English
3H-PHENOXAZINE-1,9-DICARBOXYLIC ACID, 2-ACETAMIDO-4,6-DIMETHYL-3-OXO-, DIBUTYL ESTER
Systematic Name English
3H-PHENOXAZINE-1,9-DICARBOXYLIC ACID, 2-(ACETYLAMINO)-4,6-DIMETHYL-3-OXO-, 1,9-DIBUTYL ESTER
Systematic Name English
NSC-98678
Code English
Code System Code Type Description
NSC
98678
Created by admin on Sat Dec 16 12:43:16 GMT 2023 , Edited by admin on Sat Dec 16 12:43:16 GMT 2023
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PUBCHEM
263958
Created by admin on Sat Dec 16 12:43:16 GMT 2023 , Edited by admin on Sat Dec 16 12:43:16 GMT 2023
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FDA UNII
O7TS50A3ZX
Created by admin on Sat Dec 16 12:43:16 GMT 2023 , Edited by admin on Sat Dec 16 12:43:16 GMT 2023
PRIMARY
EPA CompTox
DTXSID00157462
Created by admin on Sat Dec 16 12:43:16 GMT 2023 , Edited by admin on Sat Dec 16 12:43:16 GMT 2023
PRIMARY
CAS
13229-23-7
Created by admin on Sat Dec 16 12:43:16 GMT 2023 , Edited by admin on Sat Dec 16 12:43:16 GMT 2023
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