ethanedioate; N-(2-methoxyethyl)-1-(phenylsulfonyl)ethanamine

Systemtic Name: ethanedioate; N-(2-methoxyethyl)-1-(phenylsulfonyl)ethanamine Openeye Name: 1-(benzenesulfonyl)-N-(2-methoxyethyl)ethanamine; oxalate CAS Name: 1-(benzenesulfonyl)-N-(2-methoxyethyl)ethanamine; oxalate IUPAC Name: 1-(benzenesulfonyl)-N-(2-methoxyethyl)ethanamine; oxalate Traditional Name: 1-besylethyl(2-methoxyethyl)amine; oxalate Formula: C13H17NO7S-2 MolecularWeight: 331.34158

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Descriptors Computed from Structure

Canonical SMILES:

CC(NCCOC)S(=O)(=O)C1=CC=CC=C1.C(=O)(C(=O)[O-])[O-]

Isomeric SMILES

CC(NCCOC)S(=O)(=O)C1=CC=CC=C1.C(=O)(C(=O)[O-])[O-]

InChI

InChI=1S/C11H17NO3S.C2H2O4/c1-10(12-8-9-15-2)16(13,14)11-6-4-3-5-7-11;3-1(4)2(5)6/h3-7,10,12H,8-9H2,1-2H3;(H,3,4)(H,5,6)/p-2