(3R)-3-methyl-1-oxidanylidene-N-(3-piperidin-1-ylsulfonylphenyl)-4H-isochromene-3-carboxamide

Systemtic Name: (3R)-3-methyl-1-oxidanylidene-N-(3-piperidin-1-ylsulfonylphenyl)-4H-isochromene-3-carboxamide Openeye Name: (3R)-3-methyl-1-oxo-N-[3-(1-piperidylsulfonyl)phenyl]isochromane-3-carboxamide CAS Name: (3R)-3-methyl-1-oxo-N-[3-(1-piperidinylsulfonyl)phenyl]-3,4-dihydro-1H-2-benzopyran-3-carboxamide IUPAC Name: (3R)-3-methyl-1-oxo-N-(3-piperidin-1-ylsulfonylphenyl)-4H-isochromene-3-carboxamide Traditional Name: (3R)-1-keto-3-methyl-N-(3-piperidinosulfonylphenyl)isochroman-3-carboxamide Formula: C22H24N2O5S MolecularWeight: 428.50136

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC2=CC=CC=C2C(=O)O1)C(=O)NC3=CC(=CC=C3)S(=O)(=O)N4CCCCC4

Isomeric SMILES

C[C@@]1(CC2=CC=CC=C2C(=O)O1)C(=O)NC3=CC(=CC=C3)S(=O)(=O)N4CCCCC4

InChI

InChI=1S/C22H24N2O5S/c1-22(15-16-8-3-4-11-19(16)20(25)29-22)21(26)23-17-9-7-10-18(14-17)30(27,28)24-12-5-2-6-13-24/h3-4,7-11,14H,2,5-6,12-13,15H2,1H3,(H,23,26)/t22-/m1/s1