U.S. Department of Health & Human Services Divider Arrow National Institutes of Health Divider Arrow NCATS

Details

Stereochemistry RACEMIC
Molecular Formula C18H13N
Molecular Weight 243.3025
Optical Activity ( + / - )
Defined Stereocenters 2 / 2
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 4B,5A-DIHYDRO-5H-BENZO(3,4)PHENANTHRO(1,2-B)AZIRINE

SMILES

N1[C@@H]2[C@H]1C3=C(C4=C(C=CC=C4)C=C3)C5=C2C=CC=C5

InChI

InChIKey=JMHJDDCGYRIRMY-ZWKOTPCHSA-N
InChI=1S/C18H13N/c1-2-6-12-11(5-1)9-10-15-16(12)13-7-3-4-8-14(13)17-18(15)19-17/h1-10,17-19H/t17-,18+/m0/s1

HIDE SMILES / InChI

Approval Year

Name Type Language
4B,5A-DIHYDRO-5H-BENZO(3,4)PHENANTHRO(1,2-B)AZIRINE
Common Name English
5H-BENZO(3,4)PHENANTHRO(1,2-B)AZIRINE, 4B,5A-DIHYDRO-
Preferred Name English
Code System Code Type Description
CAS
71382-54-2
Created by admin on Tue Apr 01 18:05:42 GMT 2025 , Edited by admin on Tue Apr 01 18:05:42 GMT 2025
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FDA UNII
LAB631H11Z
Created by admin on Tue Apr 01 18:05:42 GMT 2025 , Edited by admin on Tue Apr 01 18:05:42 GMT 2025
PRIMARY
EPA CompTox
DTXSID70991719
Created by admin on Tue Apr 01 18:05:42 GMT 2025 , Edited by admin on Tue Apr 01 18:05:42 GMT 2025
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PUBCHEM
121494095
Created by admin on Tue Apr 01 18:05:42 GMT 2025 , Edited by admin on Tue Apr 01 18:05:42 GMT 2025
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