1-(3,4-dihydro-2H-thiochromen-6-yl)-2-(octylamino)propan-1-ol

Systemtic Name: 1-(3,4-dihydro-2H-thiochromen-6-yl)-2-(octylamino)propan-1-ol Openeye Name: 2-(octylamino)-1-thiochroman-6-yl-propan-1-ol CAS Name: 1-(3,4-dihydro-2H-1-benzothiopyran-6-yl)-2-(octylamino)-1-propanol IUPAC Name: 1-(3,4-dihydro-2H-thiochromen-6-yl)-2-(octylamino)propan-1-ol Traditional Name: 2-(octylamino)-1-thiochroman-6-yl-propan-1-ol Formula: C20H33NOS MolecularWeight: 335.54712

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCNC(C)C(C1=CC2=C(C=C1)SCCC2)O

Isomeric SMILES

CCCCCCCCNC(C)C(C1=CC2=C(C=C1)SCCC2)O

InChI

InChI=1S/C20H33NOS/c1-3-4-5-6-7-8-13-21-16(2)20(22)18-11-12-19-17(15-18)10-9-14-23-19/h11-12,15-16,20-22H,3-10,13-14H2,1-2H3