[3-(4-ethanoylpiperazin-1-yl)sulfonyl-4-methyl-phenyl]methylazanium

Systemtic Name: [3-(4-ethanoylpiperazin-1-yl)sulfonyl-4-methyl-phenyl]methylazanium Openeye Name: [3-(4-acetylpiperazin-1-yl)sulfonyl-4-methyl-phenyl]methylammonium CAS Name: [3-[(4-acetyl-1-piperazinyl)sulfonyl]-4-methylphenyl]methylammonium IUPAC Name: [3-(4-acetylpiperazin-1-yl)sulfonyl-4-methylphenyl]methylazanium Traditional Name: [3-(4-acetylpiperazino)sulfonyl-4-methyl-benzyl]ammonium Formula: C14H22N3O3S+ MolecularWeight: 312.40778

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C[NH3+])S(=O)(=O)N2CCN(CC2)C(=O)C

Isomeric SMILES

CC1=C(C=C(C=C1)C[NH3+])S(=O)(=O)N2CCN(CC2)C(=O)C

InChI

InChI=1S/C14H21N3O3S/c1-11-3-4-13(10-15)9-14(11)21(19,20)17-7-5-16(6-8-17)12(2)18/h3-4,9H,5-8,10,15H2,1-2H3/p+1