11-[4-(1-oxidanyl-3-piperidin-1-yl-propyl)phenyl]naphtho[2,3-b][1]benzothiole-3,9-diol

Systemtic Name: 11-[4-(1-oxidanyl-3-piperidin-1-yl-propyl)phenyl]naphtho[2,3-b][1]benzothiole-3,9-diol Openeye Name: 11-[4-[1-hydroxy-3-(1-piperidyl)propyl]phenyl]naphtho[2,3-b]benzothiophene-3,9-diol CAS Name: 11-[4-[1-hydroxy-3-(1-piperidinyl)propyl]phenyl]naphtho[2,3-b][1]benzothiole-3,9-diol IUPAC Name: 11-[4-(1-hydroxy-3-piperidin-1-ylpropyl)phenyl]naphtho[2,3-b][1]benzothiole-3,9-diol Traditional Name: 11-[4-(1-hydroxy-3-piperidino-propyl)phenyl]naphtho[2,3-b]benzothiophene-3,9-diol Formula: C30H29NO3S MolecularWeight: 483.62116

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)CCC(C2=CC=C(C=C2)C3=C4C=C(C=CC4=CC5=C3C6=C(S5)C=C(C=C6)O)O)O

Isomeric SMILES

C1CCN(CC1)CCC(C2=CC=C(C=C2)C3=C4C=C(C=CC4=CC5=C3C6=C(S5)C=C(C=C6)O)O)O

InChI

InChI=1S/C30H29NO3S/c32-22-9-8-21-16-28-30(24-11-10-23(33)18-27(24)35-28)29(25(21)17-22)20-6-4-19(5-7-20)26(34)12-15-31-13-2-1-3-14-31/h4-11,16-18,26,32-34H,1-3,12-15H2