6-methyl-10-nitro-8-(trifluoromethyl)-2,3,4,6-tetrahydro-1H-5,1-benzothiazocine

Systemtic Name: 6-methyl-10-nitro-8-(trifluoromethyl)-2,3,4,6-tetrahydro-1H-5,1-benzothiazocine Openeye Name: 6-methyl-10-nitro-8-(trifluoromethyl)-2,3,4,6-tetrahydro-1H-5,1-benzothiazocine CAS Name: 6-methyl-10-nitro-8-(trifluoromethyl)-2,3,4,6-tetrahydro-1H-5,1-benzothiazocine IUPAC Name: 6-methyl-10-nitro-8-(trifluoromethyl)-2,3,4,6-tetrahydro-1H-5,1-benzothiazocine Traditional Name: 6-methyl-10-nitro-8-(trifluoromethyl)-2,3,4,6-tetrahydro-1H-5,1-benzothiazocine Formula: C12H13F3N2O2S MolecularWeight: 306.30403

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Descriptors Computed from Structure

Canonical SMILES:

CC1C2=CC(=CC(=C2NCCCS1)[N+](=O)[O-])C(F)(F)F

Isomeric SMILES

CC1C2=CC(=CC(=C2NCCCS1)[N+](=O)[O-])C(F)(F)F

InChI

InChI=1S/C12H13F3N2O2S/c1-7-9-5-8(12(13,14)15)6-10(17(18)19)11(9)16-3-2-4-20-7/h5-7,16H,2-4H2,1H3