8-bromanyl-5-(ethoxymethyl)-5-methyl-3,4-dihydro-2H-1-benzothiepine

Systemtic Name: 8-bromanyl-5-(ethoxymethyl)-5-methyl-3,4-dihydro-2H-1-benzothiepine Openeye Name: 8-bromo-5-(ethoxymethyl)-5-methyl-3,4-dihydro-2H-1-benzothiepine CAS Name: 8-bromo-5-(ethoxymethyl)-5-methyl-3,4-dihydro-2H-1-benzothiepin IUPAC Name: 8-bromo-5-(ethoxymethyl)-5-methyl-3,4-dihydro-2H-1-benzothiepine Traditional Name: 8-bromo-5-(ethoxymethyl)-5-methyl-3,4-dihydro-2H-1-benzothiepin Formula: C14H19BrOS MolecularWeight: 315.26906

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Descriptors Computed from Structure

Canonical SMILES:

CCOCC1(CCCSC2=C1C=CC(=C2)Br)C

Isomeric SMILES

CCOCC1(CCCSC2=C1C=CC(=C2)Br)C

InChI

InChI=1S/C14H19BrOS/c1-3-16-10-14(2)7-4-8-17-13-9-11(15)5-6-12(13)14/h5-6,9H,3-4,7-8,10H2,1-2H3