2-[4-azanyl-5-[bis(2-methoxyethyl)amino]pyrazol-1-yl]ethanesulfonic acid

Systemtic Name: 2-[4-azanyl-5-[bis(2-methoxyethyl)amino]pyrazol-1-yl]ethanesulfonic acid Openeye Name: 2-[4-amino-5-[bis(2-methoxyethyl)amino]pyrazol-1-yl]ethanesulfonic acid CAS Name: 2-[4-amino-5-[bis(2-methoxyethyl)amino]-1-pyrazolyl]ethanesulfonic acid IUPAC Name: 2-[4-amino-5-[bis(2-methoxyethyl)amino]pyrazol-1-yl]ethanesulfonic acid Traditional Name: 2-[4-amino-5-[bis(2-methoxyethyl)amino]pyrazol-1-yl]ethanesulfonic acid Formula: C11H22N4O5S MolecularWeight: 322.38118

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Descriptors Computed from Structure

Canonical SMILES:

COCCN(CCOC)C1=C(C=NN1CCS(=O)(=O)O)N

Isomeric SMILES

COCCN(CCOC)C1=C(C=NN1CCS(=O)(=O)O)N

InChI

InChI=1S/C11H22N4O5S/c1-19-6-3-14(4-7-20-2)11-10(12)9-13-15(11)5-8-21(16,17)18/h9H,3-8,12H2,1-2H3,(H,16,17,18)