4-(3-ethylsulfonylpropylamino)-2,2-dimethyl-3,4-dihydrochromene-6-carboxylic acid

Systemtic Name: 4-(3-ethylsulfonylpropylamino)-2,2-dimethyl-3,4-dihydrochromene-6-carboxylic acid Openeye Name: 4-(3-ethylsulfonylpropylamino)-2,2-dimethyl-chromane-6-carboxylic acid CAS Name: 4-(3-ethylsulfonylpropylamino)-2,2-dimethyl-3,4-dihydro-2H-1-benzopyran-6-carboxylic acid IUPAC Name: 4-(3-ethylsulfonylpropylamino)-2,2-dimethyl-3,4-dihydrochromene-6-carboxylic acid Traditional Name: 4-(3-esylpropylamino)-2,2-dimethyl-chroman-6-carboxylic acid Formula: C17H25NO5S MolecularWeight: 355.4491

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Descriptors Computed from Structure

Canonical SMILES:

CCS(=O)(=O)CCCNC1CC(OC2=C1C=C(C=C2)C(=O)O)(C)C

Isomeric SMILES

CCS(=O)(=O)CCCNC1CC(OC2=C1C=C(C=C2)C(=O)O)(C)C

InChI

InChI=1S/C17H25NO5S/c1-4-24(21,22)9-5-8-18-14-11-17(2,3)23-15-7-6-12(16(19)20)10-13(14)15/h6-7,10,14,18H,4-5,8-9,11H2,1-3H3,(H,19,20)