N-[(2-methoxyphenyl)methyl]piperazin-4-ium-1-sulfonamide

Systemtic Name: N-[(2-methoxyphenyl)methyl]piperazin-4-ium-1-sulfonamide Openeye Name: N-[(2-methoxyphenyl)methyl]piperazin-4-ium-1-sulfonamide CAS Name: N-[(2-methoxyphenyl)methyl]-1-piperazin-4-iumsulfonamide IUPAC Name: N-[(2-methoxyphenyl)methyl]piperazin-4-ium-1-sulfonamide Traditional Name: N-o-anisylpiperazin-4-ium-1-sulfonamide Formula: C12H20N3O3S+ MolecularWeight: 286.3705

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1CNS(=O)(=O)N2CC[NH2+]CC2

Isomeric SMILES

COC1=CC=CC=C1CNS(=O)(=O)N2CC[NH2+]CC2

InChI

InChI=1S/C12H19N3O3S/c1-18-12-5-3-2-4-11(12)10-14-19(16,17)15-8-6-13-7-9-15/h2-5,13-14H,6-10H2,1H3/p+1