butanedioic acid; 6-methyl-N-phenyl-2,3-dihydro-1,4-oxathiine-5-carboxamide

Systemtic Name: butanedioic acid; 6-methyl-N-phenyl-2,3-dihydro-1,4-oxathiine-5-carboxamide Openeye Name: 6-methyl-N-phenyl-2,3-dihydro-1,4-oxathiine-5-carboxamide; succinic acid CAS Name: butanedioic acid; 6-methyl-N-phenyl-2,3-dihydro-1,4-oxathiin-5-carboxamide IUPAC Name: butanedioic acid; 6-methyl-N-phenyl-2,3-dihydro-1,4-oxathiine-5-carboxamide Traditional Name: 6-methyl-N-phenyl-2,3-dihydro-1,4-oxathiin-5-carboxamide; succinic acid Formula: C16H19NO6S MolecularWeight: 353.39016

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SCCO1)C(=O)NC2=CC=CC=C2.C(CC(=O)O)C(=O)O

Isomeric SMILES

CC1=C(SCCO1)C(=O)NC2=CC=CC=C2.C(CC(=O)O)C(=O)O

InChI

InChI=1S/C12H13NO2S.C4H6O4/c1-9-11(16-8-7-15-9)12(14)13-10-5-3-2-4-6-10;5-3(6)1-2-4(7)8/h2-6H,7-8H2,1H3,(H,13,14);1-2H2,(H,5,6)(H,7,8)