10-[4-(2-pyrrolidin-1-ylethoxy)phenyl]-5aH-indeno[1,2-b][1]benzothiole-3,7-diol

Systemtic Name: 10-[4-(2-pyrrolidin-1-ylethoxy)phenyl]-5aH-indeno[1,2-b][1]benzothiole-3,7-diol Openeye Name: 10-[4-(2-pyrrolidin-1-ylethoxy)phenyl]-5aH-indeno[1,2-b]benzothiophene-3,7-diol CAS Name: 10-[4-[2-(1-pyrrolidinyl)ethoxy]phenyl]-5aH-indeno[1,2-b][1]benzothiole-3,7-diol IUPAC Name: 10-[4-(2-pyrrolidin-1-ylethoxy)phenyl]-5aH-indeno[1,2-b][1]benzothiole-3,7-diol Traditional Name: 10-[4-(2-pyrrolidinoethoxy)phenyl]-5aH-indeno[1,2-b]benzothiophene-3,7-diol Formula: C27H25NO3S MolecularWeight: 443.5573

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)CCOC2=CC=C(C=C2)C3=C4C=CC(=CC4=C5C3=C6C=CC(=CC6S5)O)O

Isomeric SMILES

C1CCN(C1)CCOC2=CC=C(C=C2)C3=C4C=CC(=CC4=C5C3=C6C=CC(=CC6S5)O)O

InChI

InChI=1S/C27H25NO3S/c29-18-5-9-21-23(15-18)27-26(22-10-6-19(30)16-24(22)32-27)25(21)17-3-7-20(8-4-17)31-14-13-28-11-1-2-12-28/h3-10,15-16,24,29-30H,1-2,11-14H2