4-[5,5-dimethyl-3-[4-(phenylmethyl)piperazine-1,4-diium-1-yl]cyclohex-2-en-1-ylidene]morpholin-4-ium

Systemtic Name: 4-[5,5-dimethyl-3-[4-(phenylmethyl)piperazine-1,4-diium-1-yl]cyclohex-2-en-1-ylidene]morpholin-4-ium Openeye Name: 4-[3-(4-benzylpiperazine-1,4-diium-1-yl)-5,5-dimethyl-cyclohex-2-en-1-ylidene]morpholin-4-ium CAS Name: 4-[5,5-dimethyl-3-[4-(phenylmethyl)-1-piperazine-1,4-diiumyl]-1-cyclohex-2-enylidene]morpholin-4-ium IUPAC Name: 4-[3-(4-benzylpiperazine-1,4-diium-1-yl)-5,5-dimethylcyclohex-2-en-1-ylidene]morpholin-4-ium Traditional Name: 4-[3-(4-benzylpiperazine-1,4-diium-1-yl)-5,5-dimethyl-cyclohex-2-en-1-ylidene]morpholin-4-ium Formula: C23H36N3O+3 MolecularWeight: 370.55144

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC(=CC(=[N+]2CCOCC2)C1)[NH+]3CC[NH+](CC3)CC4=CC=CC=C4)C

Isomeric SMILES

CC1(CC(=CC(=[N+]2CCOCC2)C1)[NH+]3CC[NH+](CC3)CC4=CC=CC=C4)C

InChI

InChI=1S/C23H34N3O/c1-23(2)17-21(16-22(18-23)26-12-14-27-15-13-26)25-10-8-24(9-11-25)19-20-6-4-3-5-7-20/h3-7,16H,8-15,17-19H2,1-2H3/q+1/p+2