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sodium 3-[(phenylmethyl)carbamoylamino]propane-1-sulfonate

sodium 3-[(phenylmethyl)carbamoylamino]propane-1-sulfonate

Systemtic Name:sodium 3-[(phenylmethyl)carbamoylamino]propane-1-sulfonate
Openeye Name:sodium 3-(benzylcarbamoylamino)propane-1-sulfonate
CAS Name:sodium 3-[[oxo-[(phenylmethyl)amino]methyl]amino]-1-propanesulfonate
IUPAC Name:sodium 3-(benzylcarbamoylamino)propane-1-sulfonate
Traditional Name:sodium 3-(benzylcarbamoylamino)propane-1-sulfonate
Formula: C11H15N2NaO4S
MolecularWeight: 294.30257
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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CNC(=O)NCCCS(=O)(=O)[O-].[Na+]


Isomeric SMILES

C1=CC=C(C=C1)CNC(=O)NCCCS(=O)(=O)[O-].[Na+]


InChI

InChI=1S/C11H16N2O4S.Na/c14-11(12-7-4-8-18(15,16)17)13-9-10-5-2-1-3-6-10;/h1-3,5-6H,4,7-9H2,(H2,12,13,14)(H,15,16,17);/q;+1/p-1


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