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Details

Stereochemistry ABSOLUTE
Molecular Formula 2C19H23N3O5.C4H4O4
Molecular Weight 862.8782
Optical Activity UNSPECIFIED
Defined Stereocenters 2 / 2
E/Z Centers 1
Charge 0

SHOW SMILES / InChI
Structure of BGC-20-1259 fumarate

SMILES

OC(=O)\C=C\C(O)=O.CN[C@@H](CCOC1=CC=C(C=C1)[N+]([O-])=O)C2=CC=C(OC(=O)N(C)C)C=C2.CN[C@@H](CCOC3=CC=C(C=C3)[N+]([O-])=O)C4=CC=C(OC(=O)N(C)C)C=C4

InChI

InChIKey=JOSUCKKYZJUIPW-SOBORHNCSA-N
InChI=1S/2C19H23N3O5.C4H4O4/c2*1-20-18(12-13-26-16-10-6-15(7-11-16)22(24)25)14-4-8-17(9-5-14)27-19(23)21(2)3;5-3(6)1-2-4(7)8/h2*4-11,18,20H,12-13H2,1-3H3;1-2H,(H,5,6)(H,7,8)/b;;2-1+/t2*18-;/m00./s1

HIDE SMILES / InChI

Approval Year

Name Type Language
BGC 20-1259 fumarate
Preferred Name English
BGC-20-1259 fumarate
Code English
RS 1259
Code English
(E)-BUT-2-ENEDIOIC ACID; (4-((1S)-1-(METHYLAMINO)-3-(4-NITROPHENOXY)PROPYL)PHENYL) N,N-DIMETHYLCARBAMATE
Systematic Name English
2.4-((1S)-METHYLAMINO-3-(4-NITROPHENOXY)PROPYLPHENYL N,N-DIMETHYLCARBAMATE (FUMARIC ACID)(1-2)SALT)
Systematic Name English
(4-((3S)-3-(4-(DIMETHYLCARBAMOYLOXY)PHENYL)-3-(METHYLAMINO)PROPOXY)PHENYL)AZINIC ACID FUMARIC ACID
Systematic Name English
RS-1259
Code English
Code System Code Type Description
MANUFACTURER PRODUCT INFORMATION
(4-((3S)-3-(4-(DIMETHYLCARBAMOYLOXY)PHENYL)-3-(METHYLAMINO)PROPOXY)PHENYL)AZINIC ACID FUMARIC ACID
Created by admin on Tue Apr 01 16:59:03 GMT 2025 , Edited by admin on Tue Apr 01 16:59:03 GMT 2025
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FDA UNII
6WJ4EP5PJ5
Created by admin on Tue Apr 01 16:59:03 GMT 2025 , Edited by admin on Tue Apr 01 16:59:03 GMT 2025
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PUBCHEM
6918634
Created by admin on Tue Apr 01 16:59:03 GMT 2025 , Edited by admin on Tue Apr 01 16:59:03 GMT 2025
PRIMARY