(3S)-N-(2-methoxy-5-piperidin-1-ylsulfonyl-phenyl)-3-methyl-1-oxidanylidene-4H-isochromene-3-carboxamide

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H26N2O6S/c1-23(15-16-8-4-5-9-18(16)21(26)31-23)22(27)24-19-14-17(10-11-20(19)30-2)32(28,29)25-12-6-3-7-13-25/h4-5,8-11,14H,3,6-7,12-13,15H2,1-2H3,(H,24,27)/t23-/m0/s1