2-ethyl-6-pyrrolidin-1-ylsulfonyl-quinoline-4-carboxylic acid

Systemtic Name: 2-ethyl-6-pyrrolidin-1-ylsulfonyl-quinoline-4-carboxylic acid Openeye Name: 2-ethyl-6-pyrrolidin-1-ylsulfonyl-quinoline-4-carboxylic acid CAS Name: 2-ethyl-6-(1-pyrrolidinylsulfonyl)-4-quinolinecarboxylic acid IUPAC Name: 2-ethyl-6-pyrrolidin-1-ylsulfonylquinoline-4-carboxylic acid Traditional Name: 2-ethyl-6-pyrrolidinosulfonyl-cinchoninic acid Formula: C16H18N2O4S MolecularWeight: 334.39012

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=NC2=C(C=C(C=C2)S(=O)(=O)N3CCCC3)C(=C1)C(=O)O

Isomeric SMILES

CCC1=NC2=C(C=C(C=C2)S(=O)(=O)N3CCCC3)C(=C1)C(=O)O

InChI

InChI=1S/C16H18N2O4S/c1-2-11-9-14(16(19)20)13-10-12(5-6-15(13)17-11)23(21,22)18-7-3-4-8-18/h5-6,9-10H,2-4,7-8H2,1H3,(H,19,20)