4-[[2,2-dimethyl-4-(propylsulfonylamino)-3,4-dihydrochromen-6-yl]oxy]pentanoate

Systemtic Name: 4-[[2,2-dimethyl-4-(propylsulfonylamino)-3,4-dihydrochromen-6-yl]oxy]pentanoate Openeye Name: 4-[2,2-dimethyl-4-(propylsulfonylamino)chroman-6-yl]oxypentanoate CAS Name: 4-[[2,2-dimethyl-4-(propylsulfonylamino)-3,4-dihydro-2H-1-benzopyran-6-yl]oxy]pentanoate IUPAC Name: 4-[[2,2-dimethyl-4-(propylsulfonylamino)-3,4-dihydrochromen-6-yl]oxy]pentanoate Traditional Name: 4-[2,2-dimethyl-4-(propylsulfonylamino)chroman-6-yl]oxyvalerate Formula: C19H28NO6S- MolecularWeight: 398.49372

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCS(=O)(=O)NC1CC(OC2=C1C=C(C=C2)OC(C)CCC(=O)[O-])(C)C

Isomeric SMILES

CCCS(=O)(=O)NC1CC(OC2=C1C=C(C=C2)OC(C)CCC(=O)[O-])(C)C

InChI

InChI=1S/C19H29NO6S/c1-5-10-27(23,24)20-16-12-19(3,4)26-17-8-7-14(11-15(16)17)25-13(2)6-9-18(21)22/h7-8,11,13,16,20H,5-6,9-10,12H2,1-4H3,(H,21,22)/p-1