3-[11-[butyl(methyl)amino]undecyl]-2-(4-hydroxyphenyl)-1-benzothiophen-6-ol

Systemtic Name: 3-[11-[butyl(methyl)amino]undecyl]-2-(4-hydroxyphenyl)-1-benzothiophen-6-ol Openeye Name: 3-[11-[butyl(methyl)amino]undecyl]-2-(4-hydroxyphenyl)benzothiophen-6-ol CAS Name: 3-[11-[butyl(methyl)amino]undecyl]-2-(4-hydroxyphenyl)-1-benzothiophen-6-ol IUPAC Name: 3-[11-[butyl(methyl)amino]undecyl]-2-(4-hydroxyphenyl)-1-benzothiophen-6-ol Traditional Name: 3-[11-[butyl(methyl)amino]undecyl]-2-(4-hydroxyphenyl)benzothiophen-6-ol Formula: C30H43NO2S MolecularWeight: 481.73292

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN(C)CCCCCCCCCCCC1=C(SC2=C1C=CC(=C2)O)C3=CC=C(C=C3)O

Isomeric SMILES

CCCCN(C)CCCCCCCCCCCC1=C(SC2=C1C=CC(=C2)O)C3=CC=C(C=C3)O

InChI

InChI=1S/C30H43NO2S/c1-3-4-21-31(2)22-13-11-9-7-5-6-8-10-12-14-28-27-20-19-26(33)23-29(27)34-30(28)24-15-17-25(32)18-16-24/h15-20,23,32-33H,3-14,21-22H2,1-2H3