Details
Stereochemistry | ABSOLUTE |
Molecular Formula | C16H23N3O2.C7H6O3 |
Molecular Weight | 427.4935 |
Optical Activity | UNSPECIFIED |
Defined Stereocenters | 2 / 2 |
E/Z Centers | 0 |
Charge | 0 |
SHOW SMILES / InChI
SMILES
OC(=O)C1=CC=CC=C1O.[H][C@]23N(C)CC[C@@]2(C)C4=CC(OC(=O)N(C)C)=CC=C4N3C
InChI
InChIKey=VNVOFEHGWKIISE-XMZRARIVSA-N
InChI=1S/C16H23N3O2.C7H6O3/c1-16-8-9-18(4)14(16)19(5)13-7-6-11(10-12(13)16)21-15(20)17(2)3;8-6-4-2-1-3-5(6)7(9)10/h6-7,10,14H,8-9H2,1-5H3;1-4,8H,(H,9,10)/t14-,16+;/m1./s1
Molecular Formula | C16H23N3O2 |
Molecular Weight | 289.3727 |
Charge | 0 |
Count |
|
Stereochemistry | ABSOLUTE |
Additional Stereochemistry | No |
Defined Stereocenters | 2 / 2 |
E/Z Centers | 0 |
Optical Activity | UNSPECIFIED |
Molecular Formula | C7H6O3 |
Molecular Weight | 138.1207 |
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
Edited
Sat Dec 16 09:44:19 GMT 2023
by
admin
on
Sat Dec 16 09:44:19 GMT 2023
|
Record UNII |
5BS17Z09BZ
|
Record Status |
Validated (UNII)
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Record Version |
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-
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129101-32-2
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DTXSID00926296
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119026204
Created by
admin on Sat Dec 16 09:44:19 GMT 2023 , Edited by admin on Sat Dec 16 09:44:19 GMT 2023
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