sodium 2-[(4-methanoylphenyl)-methyl-amino]ethanesulfonic acid

Systemtic Name: sodium 2-[(4-methanoylphenyl)-methyl-amino]ethanesulfonic acid Openeye Name: sodium 2-(4-formyl-N-methyl-anilino)ethanesulfonic acid CAS Name: sodium 2-(4-formyl-N-methylanilino)ethanesulfonic acid IUPAC Name: sodium 2-(4-formyl-N-methylanilino)ethanesulfonic acid Traditional Name: sodium 2-(4-formyl-N-methyl-anilino)ethanesulfonic acid Formula: C10H13NNaO4S+ MolecularWeight: 266.26929

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Descriptors Computed from Structure

Canonical SMILES:

CN(CCS(=O)(=O)O)C1=CC=C(C=C1)C=O.[Na+]

Isomeric SMILES

CN(CCS(=O)(=O)O)C1=CC=C(C=C1)C=O.[Na+]

InChI

InChI=1S/C10H13NO4S.Na/c1-11(6-7-16(13,14)15)10-4-2-9(8-12)3-5-10;/h2-5,8H,6-7H2,1H3,(H,13,14,15);/q;+1