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Details

Stereochemistry ACHIRAL
Molecular Formula C21H17NO2S
Molecular Weight 347.43
Optical Activity UNSPECIFIED
Defined Stereocenters 2 / 2
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 1-BENZYLSULFONYL-1A,9B-DIHYDROPHENANTHRO(9,10-B)AZIRINE

SMILES

O=S(=O)(CC1=CC=CC=C1)N2[C@@H]3[C@H]2C4=CC=CC=C4C5=CC=CC=C35

InChI

InChIKey=ITJOKKLWPNWBPQ-CBQGHPETSA-N
InChI=1S/C21H17NO2S/c23-25(24,14-15-8-2-1-3-9-15)22-20-18-12-6-4-10-16(18)17-11-5-7-13-19(17)21(20)22/h1-13,20-21H,14H2/t20-,21+,22?

HIDE SMILES / InChI

Approval Year

Name Type Language
1-BENZYLSULFONYL-1A,9B-DIHYDROPHENANTHRO(9,10-B)AZIRINE
Common Name English
1H-PHENANTHRO(9,10-B)AZIRINE, 1A,9B-DIHYDRO-1-((PHENYLMETHYL)SULFONYL)-
Systematic Name English
Code System Code Type Description
CAS
106686-67-3
Created by admin on Sat Dec 16 08:59:56 GMT 2023 , Edited by admin on Sat Dec 16 08:59:56 GMT 2023
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PUBCHEM
121492235
Created by admin on Sat Dec 16 08:59:56 GMT 2023 , Edited by admin on Sat Dec 16 08:59:56 GMT 2023
PRIMARY
FDA UNII
T3UU01KR2Y
Created by admin on Sat Dec 16 08:59:56 GMT 2023 , Edited by admin on Sat Dec 16 08:59:56 GMT 2023
PRIMARY
EPA CompTox
DTXSID40910078
Created by admin on Sat Dec 16 08:59:56 GMT 2023 , Edited by admin on Sat Dec 16 08:59:56 GMT 2023
PRIMARY