1,3-bis(5-azoniaspiro[4.5]decan-8-yl)propan-2-yl N-phenylcarbamate

Systemtic Name: 1,3-bis(5-azoniaspiro[4.5]decan-8-yl)propan-2-yl N-phenylcarbamate Openeye Name: [2-(5-azoniaspiro[4.5]decan-8-yl)-1-(5-azoniaspiro[4.5]decan-8-ylmethyl)ethyl] N-phenylcarbamate CAS Name: N-phenylcarbamic acid 1,3-bis(5-azoniaspiro[4.5]decan-8-yl)propan-2-yl ester IUPAC Name: 1,3-bis(5-azoniaspiro[4.5]decan-8-yl)propan-2-yl N-phenylcarbamate Traditional Name: N-phenylcarbamic acid [2-(5-azoniaspiro[4.5]decan-8-yl)-1-(5-azoniaspiro[4.5]decan-8-ylmethyl)ethyl] ester Formula: C28H45N3O2+2 MolecularWeight: 455.6758

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[N+]2(C1)CCC(CC2)CC(CC3CC[N+]4(CCCC4)CC3)OC(=O)NC5=CC=CC=C5

Isomeric SMILES

C1CC[N+]2(C1)CCC(CC2)CC(CC3CC[N+]4(CCCC4)CC3)OC(=O)NC5=CC=CC=C5

InChI

InChI=1S/C28H44N3O2/c32-28(29-26-8-2-1-3-9-26)33-27(22-24-10-18-30(19-11-24)14-4-5-15-30)23-25-12-20-31(21-13-25)16-6-7-17-31/h1-3,8-9,24-25,27H,4-7,10-23H2/q+1/p+1