N-(2-ethoxy-5-piperidin-1-ylsulfonyl-phenyl)-1-oxidanylidene-3,4-dihydroisochromene-3-carboxamide

Systemtic Name: N-(2-ethoxy-5-piperidin-1-ylsulfonyl-phenyl)-1-oxidanylidene-3,4-dihydroisochromene-3-carboxamide Openeye Name: N-[2-ethoxy-5-(1-piperidylsulfonyl)phenyl]-1-oxo-isochromane-3-carboxamide CAS Name: N-[2-ethoxy-5-(1-piperidinylsulfonyl)phenyl]-1-oxo-3,4-dihydro-1H-2-benzopyran-3-carboxamide IUPAC Name: N-(2-ethoxy-5-piperidin-1-ylsulfonylphenyl)-1-oxo-3,4-dihydroisochromene-3-carboxamide Traditional Name: N-(2-ethoxy-5-piperidinosulfonyl-phenyl)-1-keto-isochroman-3-carboxamide Formula: C23H26N2O6S MolecularWeight: 458.52734

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)S(=O)(=O)N2CCCCC2)NC(=O)C3CC4=CC=CC=C4C(=O)O3

Isomeric SMILES

CCOC1=C(C=C(C=C1)S(=O)(=O)N2CCCCC2)NC(=O)C3CC4=CC=CC=C4C(=O)O3

InChI

InChI=1S/C23H26N2O6S/c1-2-30-20-11-10-17(32(28,29)25-12-6-3-7-13-25)15-19(20)24-22(26)21-14-16-8-4-5-9-18(16)23(27)31-21/h4-5,8-11,15,21H,2-3,6-7,12-14H2,1H3,(H,24,26)