4-(5H-thieno[2,3-c][2]benzothiepin-10-ylidene)piperidin-1-ium

Systemtic Name: 4-(5H-thieno[2,3-c][2]benzothiepin-10-ylidene)piperidin-1-ium Openeye Name: 4-(5H-thieno[2,3-c][2]benzothiepin-10-ylidene)piperidin-1-ium CAS Name: 4-(5H-thieno[2,3-c][2]benzothiepin-10-ylidene)piperidin-1-ium IUPAC Name: 4-(5H-thieno[2,3-c][2]benzothiepin-10-ylidene)piperidin-1-ium Traditional Name: 4-(5H-thieno[2,3-c][2]benzothiepin-10-ylidene)piperidin-1-ium Formula: C17H18NS2+ MolecularWeight: 300.46152

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH2+]CCC1=C2C3=C(SCC4=CC=CC=C42)SC=C3

Isomeric SMILES

C1C[NH2+]CCC1=C2C3=C(SCC4=CC=CC=C42)SC=C3

InChI

InChI=1S/C17H17NS2/c1-2-4-14-13(3-1)11-20-17-15(7-10-19-17)16(14)12-5-8-18-9-6-12/h1-4,7,10,18H,5-6,8-9,11H2/p+1