4-[butyl(ethylsulfonyl)amino]-2,2-dimethyl-3,4-dihydrochromene-6-carboxylic acid

Systemtic Name: 4-[butyl(ethylsulfonyl)amino]-2,2-dimethyl-3,4-dihydrochromene-6-carboxylic acid Openeye Name: 4-[butyl(ethylsulfonyl)amino]-2,2-dimethyl-chromane-6-carboxylic acid CAS Name: 4-[butyl(ethylsulfonyl)amino]-2,2-dimethyl-3,4-dihydro-2H-1-benzopyran-6-carboxylic acid IUPAC Name: 4-[butyl(ethylsulfonyl)amino]-2,2-dimethyl-3,4-dihydrochromene-6-carboxylic acid Traditional Name: 4-[butyl(esyl)amino]-2,2-dimethyl-chroman-6-carboxylic acid Formula: C18H27NO5S MolecularWeight: 369.47568

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN(C1CC(OC2=C1C=C(C=C2)C(=O)O)(C)C)S(=O)(=O)CC

Isomeric SMILES

CCCCN(C1CC(OC2=C1C=C(C=C2)C(=O)O)(C)C)S(=O)(=O)CC

InChI

InChI=1S/C18H27NO5S/c1-5-7-10-19(25(22,23)6-2)15-12-18(3,4)24-16-9-8-13(17(20)21)11-14(15)16/h8-9,11,15H,5-7,10,12H2,1-4H3,(H,20,21)