8-methoxy-3-(trifluoromethylsulfonyl)-1,2,4,5-tetrahydro-3-benzazepine-4-carbaldehyde

Systemtic Name: 8-methoxy-3-(trifluoromethylsulfonyl)-1,2,4,5-tetrahydro-3-benzazepine-4-carbaldehyde Openeye Name: 8-methoxy-3-(trifluoromethylsulfonyl)-1,2,4,5-tetrahydro-3-benzazepine-4-carbaldehyde CAS Name: 8-methoxy-3-(trifluoromethylsulfonyl)-1,2,4,5-tetrahydro-3-benzazepine-4-carboxaldehyde IUPAC Name: 8-methoxy-3-(trifluoromethylsulfonyl)-1,2,4,5-tetrahydro-3-benzazepine-4-carbaldehyde Traditional Name: 8-methoxy-3-triflyl-1,2,4,5-tetrahydro-3-benzazepine-4-carbaldehyde Formula: C13H14F3NO4S MolecularWeight: 337.31477

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(CC(N(CC2)S(=O)(=O)C(F)(F)F)C=O)C=C1

Isomeric SMILES

COC1=CC2=C(CC(N(CC2)S(=O)(=O)C(F)(F)F)C=O)C=C1

InChI

InChI=1S/C13H14F3NO4S/c1-21-12-3-2-9-6-11(8-18)17(5-4-10(9)7-12)22(19,20)13(14,15)16/h2-3,7-8,11H,4-6H2,1H3