2-[4-(3,4-dimethylphenyl)sulfonylpiperazin-1-ium-1-yl]-N-phenyl-N-prop-2-enyl-ethanamide

Systemtic Name: 2-[4-(3,4-dimethylphenyl)sulfonylpiperazin-1-ium-1-yl]-N-phenyl-N-prop-2-enyl-ethanamide Openeye Name: N-allyl-2-[4-(3,4-dimethylphenyl)sulfonylpiperazin-1-ium-1-yl]-N-phenyl-acetamide CAS Name: 2-[4-(3,4-dimethylphenyl)sulfonyl-1-piperazin-1-iumyl]-N-phenyl-N-prop-2-enylacetamide IUPAC Name: 2-[4-(3,4-dimethylphenyl)sulfonylpiperazin-1-ium-1-yl]-N-phenyl-N-prop-2-enylacetamide Traditional Name: N-allyl-2-[4-(3,4-dimethylphenyl)sulfonylpiperazin-1-ium-1-yl]-N-phenyl-acetamide Formula: C23H30N3O3S+ MolecularWeight: 428.5676

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H29N3O3S/c1-4-12-26(21-8-6-5-7-9-21)23(27)18-24-13-15-25(16-14-24)30(28,29)22-11-10-19(2)20(3)17-22/h4-11,17H,1,12-16,18H2,2-3H3/p+1