1-[(5-methylfuran-2-yl)methyl]-4-(4-propylphenyl)sulfonyl-piperazin-1-ium

Systemtic Name: 1-[(5-methylfuran-2-yl)methyl]-4-(4-propylphenyl)sulfonyl-piperazin-1-ium Openeye Name: 1-[(5-methyl-2-furyl)methyl]-4-(4-propylphenyl)sulfonyl-piperazin-1-ium CAS Name: 1-[(5-methyl-2-furanyl)methyl]-4-(4-propylphenyl)sulfonylpiperazin-1-ium IUPAC Name: 1-[(5-methylfuran-2-yl)methyl]-4-(4-propylphenyl)sulfonylpiperazin-1-ium Traditional Name: 1-[(5-methyl-2-furyl)methyl]-4-(4-propylphenyl)sulfonyl-piperazin-1-ium Formula: C19H27N2O3S+ MolecularWeight: 363.49428

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC=C(C=C1)S(=O)(=O)N2CC[NH+](CC2)CC3=CC=C(O3)C

Isomeric SMILES

CCCC1=CC=C(C=C1)S(=O)(=O)N2CC[NH+](CC2)CC3=CC=C(O3)C

InChI

InChI=1S/C19H26N2O3S/c1-3-4-17-6-9-19(10-7-17)25(22,23)21-13-11-20(12-14-21)15-18-8-5-16(2)24-18/h5-10H,3-4,11-15H2,1-2H3/p+1