bis(3-benzo[b][1]benzazepin-11-ylpropyl) sulfate

Systemtic Name: bis(3-benzo[b][1]benzazepin-11-ylpropyl) sulfate Openeye Name: bis(3-benzo[b][1]benzazepin-11-ylpropyl) sulfate CAS Name: sulfuric acid bis[3-(11-benzo[b][1]benzazepinyl)propyl] ester IUPAC Name: bis(3-benzo[b][1]benzazepin-11-ylpropyl) sulfate Traditional Name: sulfuric acid bis(3-benzo[b][1]benzazepin-11-ylpropyl) ester Formula: C34H32N2O4S MolecularWeight: 564.69388

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=CC3=CC=CC=C3N2CCCOS(=O)(=O)OCCCN4C5=CC=CC=C5C=CC6=CC=CC=C64

Isomeric SMILES

C1=CC=C2C(=C1)C=CC3=CC=CC=C3N2CCCOS(=O)(=O)OCCCN4C5=CC=CC=C5C=CC6=CC=CC=C64

InChI

InChI=1S/C34H32N2O4S/c37-41(38,39-25-9-23-35-31-15-5-1-11-27(31)19-20-28-12-2-6-16-32(28)35)40-26-10-24-36-33-17-7-3-13-29(33)21-22-30-14-4-8-18-34(30)36/h1-8,11-22H,9-10,23-26H2