2-[(6-butoxy-2,2-dimethyl-3,4-dihydrochromen-4-yl)methylsulfonylamino]ethanoic acid

Systemtic Name: 2-[(6-butoxy-2,2-dimethyl-3,4-dihydrochromen-4-yl)methylsulfonylamino]ethanoic acid Openeye Name: 2-[(6-butoxy-2,2-dimethyl-chroman-4-yl)methylsulfonylamino]acetic acid CAS Name: 2-[(6-butoxy-2,2-dimethyl-3,4-dihydro-2H-1-benzopyran-4-yl)methylsulfonylamino]acetic acid IUPAC Name: 2-[(6-butoxy-2,2-dimethyl-3,4-dihydrochromen-4-yl)methylsulfonylamino]acetic acid Traditional Name: 2-[(6-butoxy-2,2-dimethyl-chroman-4-yl)methylsulfonylamino]acetic acid Formula: C18H27NO6S MolecularWeight: 385.47508

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC2=C(C=C1)OC(CC2CS(=O)(=O)NCC(=O)O)(C)C

Isomeric SMILES

CCCCOC1=CC2=C(C=C1)OC(CC2CS(=O)(=O)NCC(=O)O)(C)C

InChI

InChI=1S/C18H27NO6S/c1-4-5-8-24-14-6-7-16-15(9-14)13(10-18(2,3)25-16)12-26(22,23)19-11-17(20)21/h6-7,9,13,19H,4-5,8,10-12H2,1-3H3,(H,20,21)