1-(4-propan-2-ylphenyl)sulfonyl-4-(pyridin-2-ylmethyl)piperazin-4-ium

Systemtic Name: 1-(4-propan-2-ylphenyl)sulfonyl-4-(pyridin-2-ylmethyl)piperazin-4-ium Openeye Name: 1-(4-isopropylphenyl)sulfonyl-4-(2-pyridylmethyl)piperazin-4-ium CAS Name: 1-(4-propan-2-ylphenyl)sulfonyl-4-(2-pyridinylmethyl)piperazin-4-ium IUPAC Name: 1-(4-propan-2-ylphenyl)sulfonyl-4-(pyridin-2-ylmethyl)piperazin-4-ium Traditional Name: 1-p-cumenylsulfonyl-4-(2-pyridylmethyl)piperazin-4-ium Formula: C19H26N3O2S+ MolecularWeight: 360.49364

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)S(=O)(=O)N2CC[NH+](CC2)CC3=CC=CC=N3

Isomeric SMILES

CC(C)C1=CC=C(C=C1)S(=O)(=O)N2CC[NH+](CC2)CC3=CC=CC=N3

InChI

InChI=1S/C19H25N3O2S/c1-16(2)17-6-8-19(9-7-17)25(23,24)22-13-11-21(12-14-22)15-18-5-3-4-10-20-18/h3-10,16H,11-15H2,1-2H3/p+1