3-methoxybenzo[b][1]benzothiepine-9-carbaldehyde

Systemtic Name: 3-methoxybenzo[b][1]benzothiepine-9-carbaldehyde Openeye Name: 3-methoxybenzo[b][1]benzothiepine-9-carbaldehyde CAS Name: 3-methoxy-9-benzo[b][1]benzothiepincarboxaldehyde IUPAC Name: 3-methoxybenzo[b][1]benzothiepine-9-carbaldehyde Traditional Name: 3-methoxybenzo[b][1]benzothiepin-9-carbaldehyde Formula: C16H12O2S MolecularWeight: 268.33028

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)SC3=C(C=CC(=C3)C=O)C=C2

Isomeric SMILES

COC1=CC2=C(C=C1)SC3=C(C=CC(=C3)C=O)C=C2

InChI

InChI=1S/C16H12O2S/c1-18-14-6-7-15-13(9-14)5-4-12-3-2-11(10-17)8-16(12)19-15/h2-10H,1H3