3-[bis(2-chloroethyl)amino]thiophene-2-carboxylic acid

Systemtic Name: 3-[bis(2-chloroethyl)amino]thiophene-2-carboxylic acid Openeye Name: 3-[bis(2-chloroethyl)amino]thiophene-2-carboxylic acid CAS Name: 3-[bis(2-chloroethyl)amino]-2-thiophenecarboxylic acid IUPAC Name: 3-[bis(2-chloroethyl)amino]thiophene-2-carboxylic acid Traditional Name: 3-[bis(2-chloroethyl)amino]-2-thenoic acid Formula: C9H11Cl2NO2S MolecularWeight: 268.16014

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Descriptors Computed from Structure

Canonical SMILES:

C1=CSC(=C1N(CCCl)CCCl)C(=O)O

Isomeric SMILES

C1=CSC(=C1N(CCCl)CCCl)C(=O)O

InChI

InChI=1S/C9H11Cl2NO2S/c10-2-4-12(5-3-11)7-1-6-15-8(7)9(13)14/h1,6H,2-5H2,(H,13,14)