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2-[(4-cyanophenyl)methyl-(4-ethanoylphenyl)sulfonyl-amino]ethyl-dimethyl-azanium

2-[(4-cyanophenyl)methyl-(4-ethanoylphenyl)sulfonyl-amino]ethyl-dimethyl-azanium

Systemtic Name:2-[(4-cyanophenyl)methyl-(4-ethanoylphenyl)sulfonyl-amino]ethyl-dimethyl-azanium
Openeye Name:2-[(4-acetylphenyl)sulfonyl-[(4-cyanophenyl)methyl]amino]ethyl-dimethyl-ammonium
CAS Name:2-[(4-acetylphenyl)sulfonyl-[(4-cyanophenyl)methyl]amino]ethyl-dimethylammonium
IUPAC Name:2-[(4-acetylphenyl)sulfonyl-[(4-cyanophenyl)methyl]amino]ethyl-dimethylazanium
Traditional Name:2-[(4-acetylphenyl)sulfonyl-(4-cyanobenzyl)amino]ethyl-dimethyl-ammonium
Formula: C20H24N3O3S+
MolecularWeight: 386.48786
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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC=C(C=C1)S(=O)(=O)N(CC[NH+](C)C)CC2=CC=C(C=C2)C#N


Isomeric SMILES

CC(=O)C1=CC=C(C=C1)S(=O)(=O)N(CC[NH+](C)C)CC2=CC=C(C=C2)C#N


InChI

InChI=1S/C20H23N3O3S/c1-16(24)19-8-10-20(11-9-19)27(25,26)23(13-12-22(2)3)15-18-6-4-17(14-21)5-7-18/h4-11H,12-13,15H2,1-3H3/p+1


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