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Details

Stereochemistry ACHIRAL
Molecular Formula C20H16N2O2
Molecular Weight 316.3532
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 2
Charge 0

SHOW SMILES / InChI
Structure of XANTHOCILLIN X DIMETHYL ETHER

SMILES

COC1=CC=C(C=C1)\C=C([N+]#[C-])\C(=C\C2=CC=C(OC)C=C2)[N+]#[C-]

InChI

InChIKey=VJKZMXOJMQCHRI-AXPXABNXSA-N
InChI=1S/C20H16N2O2/c1-21-19(13-15-5-9-17(23-3)10-6-15)20(22-2)14-16-7-11-18(24-4)12-8-16/h5-14H,3-4H3/b19-13-,20-14-

HIDE SMILES / InChI

Molecular Formula C20H16N2O2
Molecular Weight 316.3532
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 2
Optical Activity NONE

Approval Year

Patents
Substance Class Chemical
Created
by admin
on Sat Dec 16 02:55:55 GMT 2023
Edited
by admin
on Sat Dec 16 02:55:55 GMT 2023
Record UNII
Y2QBX70049
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
XANTHOCILLIN X DIMETHYL ETHER
Common Name English
BENZENE, 1,1'-((1Z,3Z)-2,3-DIISOCYANO-1,3-BUTADIENE-1,4-DIYL)BIS(4-METHOXY-
Systematic Name English
XANTHOCILLIN X PERMETHYL ETHER
Common Name English
XANTHOCILLIN DIMETHYL ETHER [MI]
Common Name English
(1Z,3Z)-2,3-DIISOCYANO-1,4-BIS(4-METHOXYPHENYL)-1,3-BUTADIENE XDE
Common Name English
XANTOCILLIN DIMETHYL ETHER
Common Name English
1,1'-((1Z,3Z)-2,3-DIISOCYANO-1,3-BUTADIENE-1,4-DIYL)BIS(4-METHOXYBENZENE)
Systematic Name English
Code System Code Type Description
PUBCHEM
6444453
Created by admin on Sat Dec 16 02:55:55 GMT 2023 , Edited by admin on Sat Dec 16 02:55:55 GMT 2023
PRIMARY
MERCK INDEX
m11529
Created by admin on Sat Dec 16 02:55:55 GMT 2023 , Edited by admin on Sat Dec 16 02:55:55 GMT 2023
PRIMARY Merck Index
CAS
4464-33-9
Created by admin on Sat Dec 16 02:55:55 GMT 2023 , Edited by admin on Sat Dec 16 02:55:55 GMT 2023
PRIMARY
FDA UNII
Y2QBX70049
Created by admin on Sat Dec 16 02:55:55 GMT 2023 , Edited by admin on Sat Dec 16 02:55:55 GMT 2023
PRIMARY
EPA CompTox
DTXSID001146596
Created by admin on Sat Dec 16 02:55:55 GMT 2023 , Edited by admin on Sat Dec 16 02:55:55 GMT 2023
PRIMARY