2-(quinolin-6-ylmethylsulfonyl)ethanoic acid

Systemtic Name: 2-(quinolin-6-ylmethylsulfonyl)ethanoic acid Openeye Name: 2-(6-quinolylmethylsulfonyl)acetic acid CAS Name: 2-(6-quinolinylmethylsulfonyl)acetic acid IUPAC Name: 2-(quinolin-6-ylmethylsulfonyl)acetic acid Traditional Name: 2-(6-quinolylmethylsulfonyl)acetic acid Formula: C12H11NO4S MolecularWeight: 265.28504

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=CC(=C2)CS(=O)(=O)CC(=O)O)N=C1

Isomeric SMILES

C1=CC2=C(C=CC(=C2)CS(=O)(=O)CC(=O)O)N=C1

InChI

InChI=1S/C12H11NO4S/c14-12(15)8-18(16,17)7-9-3-4-11-10(6-9)2-1-5-13-11/h1-6H,7-8H2,(H,14,15)