phenyl 3,6-bis(phenylmethyl)-10-azaspiro[4.5]decane-10-sulfonate

Systemtic Name: phenyl 3,6-bis(phenylmethyl)-10-azaspiro[4.5]decane-10-sulfonate Openeye Name: phenyl 3,6-dibenzyl-10-azaspiro[4.5]decane-10-sulfonate CAS Name: 3,6-bis(phenylmethyl)-10-azaspiro[4.5]decane-10-sulfonic acid phenyl ester IUPAC Name: phenyl 3,6-dibenzyl-10-azaspiro[4.5]decane-10-sulfonate Traditional Name: 3,6-dibenzyl-10-azaspiro[4.5]decane-10-sulfonic acid phenyl ester Formula: C29H33NO3S MolecularWeight: 475.64222

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(C2(CCC(C2)CC3=CC=CC=C3)N(C1)S(=O)(=O)OC4=CC=CC=C4)CC5=CC=CC=C5

Isomeric SMILES

C1CC(C2(CCC(C2)CC3=CC=CC=C3)N(C1)S(=O)(=O)OC4=CC=CC=C4)CC5=CC=CC=C5

InChI

InChI=1S/C29H33NO3S/c31-34(32,33-28-16-8-3-9-17-28)30-20-10-15-27(22-25-13-6-2-7-14-25)29(30)19-18-26(23-29)21-24-11-4-1-5-12-24/h1-9,11-14,16-17,26-27H,10,15,18-23H2