Hello,

 

Actually, OpenBabel add aromaticity in SMILES, eg :

 

This SMILES : C1=CC2C=CC3CC=CC4C=CC(=C1)C=2C=34

Is convert into : c1cc2ccc3CC=CC4C=Cc(c1)c2c34

 

I've already tried the option "-ocan" but aromaticity is still in :
C1=CC2C=Cc3c4c2c(C1)ccc4ccc3

 

Is there any option/flag to use with the babel/obabel binary to disable it ?

 

Best regards,

Camille Gardet

 

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