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Details

Stereochemistry ABSOLUTE
Molecular Formula C14H18ClN3O2.ClH
Molecular Weight 332.226
Optical Activity UNSPECIFIED
Defined Stereocenters 1 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of ADR-851

SMILES

Cl.NC1=C(Cl)C=C(C(=O)NC[C@@H]2CCCN2)C3=C1CCO3

InChI

InChIKey=PCBGZTCWZUGEJX-QRPNPIFTSA-N
InChI=1S/C14H18ClN3O2.ClH/c15-11-6-10(13-9(12(11)16)3-5-20-13)14(19)18-7-8-2-1-4-17-8;/h6,8,17H,1-5,7,16H2,(H,18,19);1H/t8-;/m0./s1

HIDE SMILES / InChI

Approval Year

Name Type Language
7-BENZOFURANCARBOXAMIDE, 4-AMINO-5-CHLORO-2,3-DIHYDRO-N-((2S)-2-PYRROLIDINYLMETHYL)-, MONOHYDROCHLORIDE
Preferred Name English
ADR-851
Code English
7-BENZOFURANCARBOXAMIDE, 4-AMINO-5-CHLORO-2,3-DIHYDRO-N-(2-PYRROLIDINYLMETHYL)-, MONOHYDROCHLORIDE, (S)-
Systematic Name English
Code System Code Type Description
EPA CompTox
DTXSID00154097
Created by admin on Mon Mar 31 18:11:37 GMT 2025 , Edited by admin on Mon Mar 31 18:11:37 GMT 2025
PRIMARY
PUBCHEM
130053
Created by admin on Mon Mar 31 18:11:37 GMT 2025 , Edited by admin on Mon Mar 31 18:11:37 GMT 2025
PRIMARY
FDA UNII
303JW6Z3QJ
Created by admin on Mon Mar 31 18:11:37 GMT 2025 , Edited by admin on Mon Mar 31 18:11:37 GMT 2025
PRIMARY
CAS
123805-17-4
Created by admin on Mon Mar 31 18:11:37 GMT 2025 , Edited by admin on Mon Mar 31 18:11:37 GMT 2025
PRIMARY