2-(6-methoxy-7-phenylmethoxy-3,4-dihydro-2H-chromen-2-yl)ethanesulfonic acid

Systemtic Name: 2-(6-methoxy-7-phenylmethoxy-3,4-dihydro-2H-chromen-2-yl)ethanesulfonic acid Openeye Name: 2-(7-benzyloxy-6-methoxy-chroman-2-yl)ethanesulfonic acid CAS Name: 2-(6-methoxy-7-phenylmethoxy-3,4-dihydro-2H-1-benzopyran-2-yl)ethanesulfonic acid IUPAC Name: 2-(6-methoxy-7-phenylmethoxy-3,4-dihydro-2H-chromen-2-yl)ethanesulfonic acid Traditional Name: 2-(7-benzoxy-6-methoxy-chroman-2-yl)ethanesulfonic acid Formula: C19H22O6S MolecularWeight: 378.43938

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(=C1)CCC(O2)CCS(=O)(=O)O)OCC3=CC=CC=C3

Isomeric SMILES

COC1=C(C=C2C(=C1)CCC(O2)CCS(=O)(=O)O)OCC3=CC=CC=C3

InChI

InChI=1S/C19H22O6S/c1-23-18-11-15-7-8-16(9-10-26(20,21)22)25-17(15)12-19(18)24-13-14-5-3-2-4-6-14/h2-6,11-12,16H,7-10,13H2,1H3,(H,20,21,22)