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Details

Stereochemistry RACEMIC
Molecular Formula C17H24N2O3.ClH
Molecular Weight 340.845
Optical Activity ( + / - )
Defined Stereocenters 2 / 2
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 3,4-METHYLENEDIOXY U-47700 HYDROCHLORIDE

SMILES

Cl.CN(C)[C@@H]1CCCC[C@H]1N(C)C(=O)C2=CC3=C(OCO3)C=C2

InChI

InChIKey=ZPTQZELVNIYZOS-DTPOWOMPSA-N
InChI=1S/C17H24N2O3.ClH/c1-18(2)13-6-4-5-7-14(13)19(3)17(20)12-8-9-15-16(10-12)22-11-21-15;/h8-10,13-14H,4-7,11H2,1-3H3;1H/t13-,14-;/m1./s1

HIDE SMILES / InChI

Molecular Formula ClH
Molecular Weight 36.461
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Molecular Formula C17H24N2O3
Molecular Weight 304.3841
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 2 / 2
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 11:01:50 GMT 2023
Edited
by admin
on Sat Dec 16 11:01:50 GMT 2023
Record UNII
MF4QKB76SV
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
3,4-METHYLENEDIOXY U-47700 HYDROCHLORIDE
Common Name English
TRANS-N-2-(DIMETHYLAMINO)CYCLOHEXYL)-N-METHYLBENZO(D)(1,3)DIOXOLE-5-CARBOXAMIDE, MONOHYDROCHLORIDE
Systematic Name English
3,4-MDO-U-47700 HYDROCHLORIDE
Common Name English
Code System Code Type Description
FDA UNII
MF4QKB76SV
Created by admin on Sat Dec 16 11:01:50 GMT 2023 , Edited by admin on Sat Dec 16 11:01:50 GMT 2023
PRIMARY
PUBCHEM
139598236
Created by admin on Sat Dec 16 11:01:50 GMT 2023 , Edited by admin on Sat Dec 16 11:01:50 GMT 2023
PRIMARY
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