[7,9-bis(2-diethylaminoethyl)-8-(hydroxymethyl)phenoxathiin-3-yl]methanol

Systemtic Name: [7,9-bis(2-diethylaminoethyl)-8-(hydroxymethyl)phenoxathiin-3-yl]methanol Openeye Name: [7,9-bis(2-diethylaminoethyl)-8-(hydroxymethyl)phenoxathiin-3-yl]methanol CAS Name: [7,9-bis(2-diethylaminoethyl)-8-(hydroxymethyl)-3-phenoxathiinyl]methanol IUPAC Name: [7,9-bis(2-diethylaminoethyl)-8-(hydroxymethyl)phenoxathiin-3-yl]methanol Traditional Name: [7,9-bis(2-diethylaminoethyl)-8-methylol-phenoxathiin-3-yl]methanol Formula: C26H38N2O3S MolecularWeight: 458.65652

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CCC1=CC2=C(C(=C1CO)CCN(CC)CC)SC3=C(O2)C=C(C=C3)CO

Isomeric SMILES

CCN(CC)CCC1=CC2=C(C(=C1CO)CCN(CC)CC)SC3=C(O2)C=C(C=C3)CO

InChI

InChI=1S/C26H38N2O3S/c1-5-27(6-2)13-11-20-16-24-26(21(22(20)18-30)12-14-28(7-3)8-4)32-25-10-9-19(17-29)15-23(25)31-24/h9-10,15-16,29-30H,5-8,11-14,17-18H2,1-4H3