1-(furan-2-ylmethyl)-4-(4-propylphenyl)sulfonyl-piperazin-1-ium

Systemtic Name: 1-(furan-2-ylmethyl)-4-(4-propylphenyl)sulfonyl-piperazin-1-ium Openeye Name: 1-(2-furylmethyl)-4-(4-propylphenyl)sulfonyl-piperazin-1-ium CAS Name: 1-(2-furanylmethyl)-4-(4-propylphenyl)sulfonylpiperazin-1-ium IUPAC Name: 1-(furan-2-ylmethyl)-4-(4-propylphenyl)sulfonylpiperazin-1-ium Traditional Name: 1-(2-furfuryl)-4-(4-propylphenyl)sulfonyl-piperazin-1-ium Formula: C18H25N2O3S+ MolecularWeight: 349.4677

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC=C(C=C1)S(=O)(=O)N2CC[NH+](CC2)CC3=CC=CO3

Isomeric SMILES

CCCC1=CC=C(C=C1)S(=O)(=O)N2CC[NH+](CC2)CC3=CC=CO3

InChI

InChI=1S/C18H24N2O3S/c1-2-4-16-6-8-18(9-7-16)24(21,22)20-12-10-19(11-13-20)15-17-5-3-14-23-17/h3,5-9,14H,2,4,10-13,15H2,1H3/p+1