methyl-(3-methyl-4-piperazin-1-yl-phenyl)sulfamic acid

Systemtic Name: methyl-(3-methyl-4-piperazin-1-yl-phenyl)sulfamic acid Openeye Name: methyl-(3-methyl-4-piperazin-1-yl-phenyl)sulfamic acid CAS Name: methyl-[3-methyl-4-(1-piperazinyl)phenyl]sulfamic acid IUPAC Name: methyl-(3-methyl-4-piperazin-1-ylphenyl)sulfamic acid Traditional Name: methyl-(3-methyl-4-piperazino-phenyl)sulfamic acid Formula: C12H19N3O3S MolecularWeight: 285.36256

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)N(C)S(=O)(=O)O)N2CCNCC2

Isomeric SMILES

CC1=C(C=CC(=C1)N(C)S(=O)(=O)O)N2CCNCC2

InChI

InChI=1S/C12H19N3O3S/c1-10-9-11(14(2)19(16,17)18)3-4-12(10)15-7-5-13-6-8-15/h3-4,9,13H,5-8H2,1-2H3,(H,16,17,18)