1-oxidanylidene-N-(3-oxidanylpropyl)isothiochromene-3-carboxamide

Systemtic Name: 1-oxidanylidene-N-(3-oxidanylpropyl)isothiochromene-3-carboxamide Openeye Name: N-(3-hydroxypropyl)-1-oxo-isothiochromene-3-carboxamide CAS Name: N-(3-hydroxypropyl)-1-oxo-2-benzothiopyran-3-carboxamide IUPAC Name: N-(3-hydroxypropyl)-1-oxoisothiochromene-3-carboxamide Traditional Name: N-(3-hydroxypropyl)-1-keto-isothiochromene-3-carboxamide Formula: C13H13NO3S MolecularWeight: 263.31222

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=C(SC2=O)C(=O)NCCCO

Isomeric SMILES

C1=CC=C2C(=C1)C=C(SC2=O)C(=O)NCCCO

InChI

InChI=1S/C13H13NO3S/c15-7-3-6-14-12(16)11-8-9-4-1-2-5-10(9)13(17)18-11/h1-2,4-5,8,15H,3,6-7H2,(H,14,16)