4-(9-azanylnonyl)-3-(4-hydroxyphenyl)-3-methyl-2,4-dihydrothiochromen-7-ol

Systemtic Name: 4-(9-azanylnonyl)-3-(4-hydroxyphenyl)-3-methyl-2,4-dihydrothiochromen-7-ol Openeye Name: 4-(9-aminononyl)-3-(4-hydroxyphenyl)-3-methyl-thiochroman-7-ol CAS Name: 4-(9-aminononyl)-3-(4-hydroxyphenyl)-3-methyl-2,4-dihydro-1-benzothiopyran-7-ol IUPAC Name: 4-(9-aminononyl)-3-(4-hydroxyphenyl)-3-methyl-2,4-dihydrothiochromen-7-ol Traditional Name: 4-(9-aminononyl)-3-(4-hydroxyphenyl)-3-methyl-thiochroman-7-ol Formula: C25H35NO2S MolecularWeight: 413.6159

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CSC2=C(C1CCCCCCCCCN)C=CC(=C2)O)C3=CC=C(C=C3)O

Isomeric SMILES

CC1(CSC2=C(C1CCCCCCCCCN)C=CC(=C2)O)C3=CC=C(C=C3)O

InChI

InChI=1S/C25H35NO2S/c1-25(19-10-12-20(27)13-11-19)18-29-24-17-21(28)14-15-22(24)23(25)9-7-5-3-2-4-6-8-16-26/h10-15,17,23,27-28H,2-9,16,18,26H2,1H3