7-prop-1-en-2-yl-2,3,4,5-tetrahydro-1-benzothiepine

Systemtic Name: 7-prop-1-en-2-yl-2,3,4,5-tetrahydro-1-benzothiepine Openeye Name: 7-isopropenyl-2,3,4,5-tetrahydro-1-benzothiepine CAS Name: 7-(1-methylethenyl)-2,3,4,5-tetrahydro-1-benzothiepin IUPAC Name: 7-prop-1-en-2-yl-2,3,4,5-tetrahydro-1-benzothiepine Traditional Name: 7-isopropenyl-2,3,4,5-tetrahydro-1-benzothiepin Formula: C13H16S MolecularWeight: 204.33114

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Descriptors Computed from Structure

Canonical SMILES:

CC(=C)C1=CC2=C(C=C1)SCCCC2

Isomeric SMILES

CC(=C)C1=CC2=C(C=C1)SCCCC2

InChI

InChI=1S/C13H16S/c1-10(2)11-6-7-13-12(9-11)5-3-4-8-14-13/h6-7,9H,1,3-5,8H2,2H3