phenyl 10,11-bis(phenylmethyl)-11-azaspiro[5.5]undecane-4-sulfonate

Systemtic Name: phenyl 10,11-bis(phenylmethyl)-11-azaspiro[5.5]undecane-4-sulfonate Openeye Name: phenyl 10,11-dibenzyl-11-azaspiro[5.5]undecane-4-sulfonate CAS Name: 10,11-bis(phenylmethyl)-11-azaspiro[5.5]undecane-4-sulfonic acid phenyl ester IUPAC Name: phenyl 10,11-dibenzyl-11-azaspiro[5.5]undecane-4-sulfonate Traditional Name: 10,11-dibenzyl-11-azaspiro[5.5]undecane-4-sulfonic acid phenyl ester Formula: C30H35NO3S MolecularWeight: 489.6688

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CC2(C1)CCCC(N2CC3=CC=CC=C3)CC4=CC=CC=C4)S(=O)(=O)OC5=CC=CC=C5

Isomeric SMILES

C1CC(CC2(C1)CCCC(N2CC3=CC=CC=C3)CC4=CC=CC=C4)S(=O)(=O)OC5=CC=CC=C5

InChI

InChI=1S/C30H35NO3S/c32-35(33,34-28-17-8-3-9-18-28)29-19-11-21-30(23-29)20-10-16-27(22-25-12-4-1-5-13-25)31(30)24-26-14-6-2-7-15-26/h1-9,12-15,17-18,27,29H,10-11,16,19-24H2