N-(cyclohexen-1-yl)-2-[4-(4-ethanoylphenyl)sulfonylpiperazin-1-ium-1-yl]-N-(furan-2-ylmethyl)ethanamide

Systemtic Name: N-(cyclohexen-1-yl)-2-[4-(4-ethanoylphenyl)sulfonylpiperazin-1-ium-1-yl]-N-(furan-2-ylmethyl)ethanamide Openeye Name: 2-[4-(4-acetylphenyl)sulfonylpiperazin-1-ium-1-yl]-N-(cyclohexen-1-yl)-N-(2-furylmethyl)acetamide CAS Name: 2-[4-(4-acetylphenyl)sulfonyl-1-piperazin-1-iumyl]-N-(1-cyclohexenyl)-N-(2-furanylmethyl)acetamide IUPAC Name: 2-[4-(4-acetylphenyl)sulfonylpiperazin-1-ium-1-yl]-N-(cyclohexen-1-yl)-N-(furan-2-ylmethyl)acetamide Traditional Name: 2-[4-(4-acetylphenyl)sulfonylpiperazin-1-ium-1-yl]-N-(cyclohexen-1-yl)-N-(2-furfuryl)acetamide Formula: C25H32N3O5S+ MolecularWeight: 486.60368

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC=C(C=C1)S(=O)(=O)N2CC[NH+](CC2)CC(=O)N(CC3=CC=CO3)C4=CCCCC4

Isomeric SMILES

CC(=O)C1=CC=C(C=C1)S(=O)(=O)N2CC[NH+](CC2)CC(=O)N(CC3=CC=CO3)C4=CCCCC4

InChI

InChI=1S/C25H31N3O5S/c1-20(29)21-9-11-24(12-10-21)34(31,32)27-15-13-26(14-16-27)19-25(30)28(18-23-8-5-17-33-23)22-6-3-2-4-7-22/h5-6,8-12,17H,2-4,7,13-16,18-19H2,1H3/p+1