7,9-dimethoxy-3,5-dihydro-2H-1,4-benzothiazepine-4-carbaldehyde

Systemtic Name: 7,9-dimethoxy-3,5-dihydro-2H-1,4-benzothiazepine-4-carbaldehyde Openeye Name: 7,9-dimethoxy-3,5-dihydro-2H-1,4-benzothiazepine-4-carbaldehyde CAS Name: 7,9-dimethoxy-3,5-dihydro-2H-1,4-benzothiazepine-4-carboxaldehyde IUPAC Name: 7,9-dimethoxy-3,5-dihydro-2H-1,4-benzothiazepine-4-carbaldehyde Traditional Name: 7,9-dimethoxy-3,5-dihydro-2H-1,4-benzothiazepine-4-carbaldehyde Formula: C12H15NO3S MolecularWeight: 253.3174

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C2C(=C1)CN(CCS2)C=O)OC

Isomeric SMILES

COC1=CC(=C2C(=C1)CN(CCS2)C=O)OC

InChI

InChI=1S/C12H15NO3S/c1-15-10-5-9-7-13(8-14)3-4-17-12(9)11(6-10)16-2/h5-6,8H,3-4,7H2,1-2H3