1-benzothiophen-3-ylmethyl-bis(2-chloroethyl)azanium

Systemtic Name: 1-benzothiophen-3-ylmethyl-bis(2-chloroethyl)azanium Openeye Name: benzothiophen-3-ylmethyl-bis(2-chloroethyl)ammonium CAS Name: 1-benzothiophen-3-ylmethyl-bis(2-chloroethyl)ammonium IUPAC Name: 1-benzothiophen-3-ylmethyl-bis(2-chloroethyl)azanium Traditional Name: benzothiophen-3-ylmethyl-bis(2-chloroethyl)ammonium Formula: C13H16Cl2NS+ MolecularWeight: 289.24384

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=CS2)C[NH+](CCCl)CCCl

Isomeric SMILES

C1=CC=C2C(=C1)C(=CS2)C[NH+](CCCl)CCCl

InChI

InChI=1S/C13H15Cl2NS/c14-5-7-16(8-6-15)9-11-10-17-13-4-2-1-3-12(11)13/h1-4,10H,5-9H2/p+1