[5-(4-ethanoylpiperazin-1-yl)sulfonyl-2-methoxy-phenyl]methylazanium

Systemtic Name: [5-(4-ethanoylpiperazin-1-yl)sulfonyl-2-methoxy-phenyl]methylazanium Openeye Name: [5-(4-acetylpiperazin-1-yl)sulfonyl-2-methoxy-phenyl]methylammonium CAS Name: [5-[(4-acetyl-1-piperazinyl)sulfonyl]-2-methoxyphenyl]methylammonium IUPAC Name: [5-(4-acetylpiperazin-1-yl)sulfonyl-2-methoxyphenyl]methylazanium Traditional Name: [5-(4-acetylpiperazino)sulfonyl-2-methoxy-benzyl]ammonium Formula: C14H22N3O4S+ MolecularWeight: 328.40718

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1CCN(CC1)S(=O)(=O)C2=CC(=C(C=C2)OC)C[NH3+]

Isomeric SMILES

CC(=O)N1CCN(CC1)S(=O)(=O)C2=CC(=C(C=C2)OC)C[NH3+]

InChI

InChI=1S/C14H21N3O4S/c1-11(18)16-5-7-17(8-6-16)22(19,20)13-3-4-14(21-2)12(9-13)10-15/h3-4,9H,5-8,10,15H2,1-2H3/p+1