2-[4-(2,4-dimethylphenyl)sulfonylpiperazin-1-ium-1-yl]-N-phenyl-N-propan-2-yl-ethanamide

Systemtic Name: 2-[4-(2,4-dimethylphenyl)sulfonylpiperazin-1-ium-1-yl]-N-phenyl-N-propan-2-yl-ethanamide Openeye Name: 2-[4-(2,4-dimethylphenyl)sulfonylpiperazin-1-ium-1-yl]-N-isopropyl-N-phenyl-acetamide CAS Name: 2-[4-(2,4-dimethylphenyl)sulfonyl-1-piperazin-1-iumyl]-N-phenyl-N-propan-2-ylacetamide IUPAC Name: 2-[4-(2,4-dimethylphenyl)sulfonylpiperazin-1-ium-1-yl]-N-phenyl-N-propan-2-ylacetamide Traditional Name: 2-[4-(2,4-dimethylphenyl)sulfonylpiperazin-1-ium-1-yl]-N-isopropyl-N-phenyl-acetamide Formula: C23H32N3O3S+ MolecularWeight: 430.58348

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)S(=O)(=O)N2CC[NH+](CC2)CC(=O)N(C3=CC=CC=C3)C(C)C)C

Isomeric SMILES

CC1=CC(=C(C=C1)S(=O)(=O)N2CC[NH+](CC2)CC(=O)N(C3=CC=CC=C3)C(C)C)C

InChI

InChI=1S/C23H31N3O3S/c1-18(2)26(21-8-6-5-7-9-21)23(27)17-24-12-14-25(15-13-24)30(28,29)22-11-10-19(3)16-20(22)4/h5-11,16,18H,12-15,17H2,1-4H3/p+1