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

Systemtic Name: 2-[4-[(2,2-dimethyl-6-phenylmethoxy-3,4-dihydrochromen-4-yl)-methylsulfonyl-amino]butoxy]ethanoic acid Openeye Name: 2-[4-[(6-benzyloxy-2,2-dimethyl-chroman-4-yl)-methylsulfonyl-amino]butoxy]acetic acid CAS Name: 2-[4-[(2,2-dimethyl-6-phenylmethoxy-3,4-dihydro-2H-1-benzopyran-4-yl)-methylsulfonylamino]butoxy]acetic acid IUPAC Name: 2-[4-[(2,2-dimethyl-6-phenylmethoxy-3,4-dihydrochromen-4-yl)-methylsulfonylamino]butoxy]acetic acid Traditional Name: 2-[4-[(6-benzoxy-2,2-dimethyl-chroman-4-yl)-mesyl-amino]butoxy]acetic acid Formula: C25H33NO7S MolecularWeight: 491.59702

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC(C2=C(O1)C=CC(=C2)OCC3=CC=CC=C3)N(CCCCOCC(=O)O)S(=O)(=O)C)C

Isomeric SMILES

CC1(CC(C2=C(O1)C=CC(=C2)OCC3=CC=CC=C3)N(CCCCOCC(=O)O)S(=O)(=O)C)C

InChI

InChI=1S/C25H33NO7S/c1-25(2)16-22(26(34(3,29)30)13-7-8-14-31-18-24(27)28)21-15-20(11-12-23(21)33-25)32-17-19-9-5-4-6-10-19/h4-6,9-12,15,22H,7-8,13-14,16-18H2,1-3H3,(H,27,28)