6-ethyl-5-methoxy-benzo[b][1]benzothiepine-2,3-diol

Systemtic Name: 6-ethyl-5-methoxy-benzo[b][1]benzothiepine-2,3-diol Openeye Name: 6-ethyl-5-methoxy-benzo[b][1]benzothiepine-2,3-diol CAS Name: 6-ethyl-5-methoxybenzo[b][1]benzothiepin-2,3-diol IUPAC Name: 6-ethyl-5-methoxybenzo[b][1]benzothiepine-2,3-diol Traditional Name: 6-ethyl-5-methoxy-benzo[b][1]benzothiepin-2,3-diol Formula: C17H16O3S MolecularWeight: 300.37214

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C2=CC(=C(C=C2SC3=CC=CC=C31)O)O)OC

Isomeric SMILES

CCC1=C(C2=CC(=C(C=C2SC3=CC=CC=C31)O)O)OC

InChI

InChI=1S/C17H16O3S/c1-3-10-11-6-4-5-7-15(11)21-16-9-14(19)13(18)8-12(16)17(10)20-2/h4-9,18-19H,3H2,1-2H3