1-[2-[(6-methoxy-1-oxidanylidene-3,4-dihydro-2H-thiochromen-7-yl)oxy]ethylamino]-3-(2-methylphenoxy)propan-2-ol

Systemtic Name: 1-[2-[(6-methoxy-1-oxidanylidene-3,4-dihydro-2H-thiochromen-7-yl)oxy]ethylamino]-3-(2-methylphenoxy)propan-2-ol Openeye Name: 1-[2-[(6-methoxy-1-oxo-3,4-dihydro-2H-thiochromen-7-yl)oxy]ethylamino]-3-(2-methylphenoxy)propan-2-ol CAS Name: 1-[2-[(6-methoxy-1-oxo-3,4-dihydro-2H-1-benzothiopyran-7-yl)oxy]ethylamino]-3-(2-methylphenoxy)-2-propanol IUPAC Name: 1-[2-[(6-methoxy-1-oxo-3,4-dihydro-2H-thiochromen-7-yl)oxy]ethylamino]-3-(2-methylphenoxy)propan-2-ol Traditional Name: 1-[2-[(1-keto-6-methoxy-3,4-dihydro-2H-thiochromen-7-yl)oxy]ethylamino]-3-(2-methylphenoxy)propan-2-ol Formula: C22H29NO5S MolecularWeight: 419.53436

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1OCC(CNCCOC2=C(C=C3CCCS(=O)C3=C2)OC)O

Isomeric SMILES

CC1=CC=CC=C1OCC(CNCCOC2=C(C=C3CCCS(=O)C3=C2)OC)O

InChI

InChI=1S/C22H29NO5S/c1-16-6-3-4-8-19(16)28-15-18(24)14-23-9-10-27-21-13-22-17(12-20(21)26-2)7-5-11-29(22)25/h3-4,6,8,12-13,18,23-24H,5,7,9-11,14-15H2,1-2H3