(3R)-4-fluoranyl-7-[(4-methoxy-3-piperidin-1-ylsulfonyl-phenyl)amino]-3-methyl-2,3-dihydroinden-1-one

Systemtic Name: (3R)-4-fluoranyl-7-[(4-methoxy-3-piperidin-1-ylsulfonyl-phenyl)amino]-3-methyl-2,3-dihydroinden-1-one Openeye Name: (3R)-4-fluoro-7-[4-methoxy-3-(1-piperidylsulfonyl)anilino]-3-methyl-indan-1-one CAS Name: (3R)-4-fluoro-7-[4-methoxy-3-(1-piperidinylsulfonyl)anilino]-3-methyl-2,3-dihydroinden-1-one IUPAC Name: (3R)-4-fluoro-7-(4-methoxy-3-piperidin-1-ylsulfonylanilino)-3-methyl-2,3-dihydroinden-1-one Traditional Name: (3R)-4-fluoro-7-(4-methoxy-3-piperidinosulfonyl-anilino)-3-methyl-indan-1-one Formula: C22H25FN2O4S MolecularWeight: 432.508303

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC(=O)C2=C(C=CC(=C12)F)NC3=CC(=C(C=C3)OC)S(=O)(=O)N4CCCCC4

Isomeric SMILES

C[C@@H]1CC(=O)C2=C(C=CC(=C12)F)NC3=CC(=C(C=C3)OC)S(=O)(=O)N4CCCCC4

InChI

InChI=1S/C22H25FN2O4S/c1-14-12-18(26)22-17(8-7-16(23)21(14)22)24-15-6-9-19(29-2)20(13-15)30(27,28)25-10-4-3-5-11-25/h6-9,13-14,24H,3-5,10-12H2,1-2H3/t14-/m1/s1