(7-oxidanyl-2,3,4,5-tetrahydro-1H-benzo[g][1]benzazepin-1-yl)methyl methanesulfonate

Systemtic Name: (7-oxidanyl-2,3,4,5-tetrahydro-1H-benzo[g][1]benzazepin-1-yl)methyl methanesulfonate Openeye Name: (7-hydroxy-2,3,4,5-tetrahydro-1H-benzo[g][1]benzazepin-1-yl)methyl methanesulfonate CAS Name: methanesulfonic acid (7-hydroxy-2,3,4,5-tetrahydro-1H-benzo[g][1]benzazepin-1-yl)methyl ester IUPAC Name: (7-hydroxy-2,3,4,5-tetrahydro-1H-benzo[g][1]benzazepin-1-yl)methyl methanesulfonate Traditional Name: methanesulfonic acid (7-hydroxy-2,3,4,5-tetrahydro-1H-benzo[g][1]benzazepin-1-yl)methyl ester Formula: C16H19NO4S MolecularWeight: 321.39136

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)OCC1CCCNC2=C1C3=CC=CC=C3C(=C2)O

Isomeric SMILES

CS(=O)(=O)OCC1CCCNC2=C1C3=CC=CC=C3C(=C2)O

InChI

InChI=1S/C16H19NO4S/c1-22(19,20)21-10-11-5-4-8-17-14-9-15(18)12-6-2-3-7-13(12)16(11)14/h2-3,6-7,9,11,17-18H,4-5,8,10H2,1H3