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

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

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C2C(=C1)N(CCCS2)C=O)OC

Isomeric SMILES

COC1=CC(=C2C(=C1)N(CCCS2)C=O)OC

InChI

InChI=1S/C12H15NO3S/c1-15-9-6-10-12(11(7-9)16-2)17-5-3-4-13(10)8-14/h6-8H,3-5H2,1-2H3