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

Systemtic Name: phenyl 10-bromanyl-6-(phenylmethyl)-10-azaspiro[4.5]decane-3-sulfonate Openeye Name: phenyl 6-benzyl-10-bromo-10-azaspiro[4.5]decane-3-sulfonate CAS Name: 10-bromo-6-(phenylmethyl)-10-azaspiro[4.5]decane-3-sulfonic acid phenyl ester IUPAC Name: phenyl 6-benzyl-10-bromo-10-azaspiro[4.5]decane-3-sulfonate Traditional Name: 6-benzyl-10-bromo-10-azaspiro[4.5]decane-3-sulfonic acid phenyl ester Formula: C22H26BrNO3S MolecularWeight: 464.41574

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(C2(CCC(C2)S(=O)(=O)OC3=CC=CC=C3)N(C1)Br)CC4=CC=CC=C4

Isomeric SMILES

C1CC(C2(CCC(C2)S(=O)(=O)OC3=CC=CC=C3)N(C1)Br)CC4=CC=CC=C4

InChI

InChI=1S/C22H26BrNO3S/c23-24-15-7-10-19(16-18-8-3-1-4-9-18)22(24)14-13-21(17-22)28(25,26)27-20-11-5-2-6-12-20/h1-6,8-9,11-12,19,21H,7,10,13-17H2