N-(1-cyano-6-phenoxy-2,3-dihydro-1H-inden-5-yl)-N-methylsulfonyl-methanesulfonamide

Systemtic Name: N-(1-cyano-6-phenoxy-2,3-dihydro-1H-inden-5-yl)-N-methylsulfonyl-methanesulfonamide Openeye Name: N-(1-cyano-6-phenoxy-indan-5-yl)-N-methylsulfonyl-methanesulfonamide CAS Name: N-(1-cyano-6-phenoxy-2,3-dihydro-1H-inden-5-yl)-N-methylsulfonylmethanesulfonamide IUPAC Name: N-(1-cyano-6-phenoxy-2,3-dihydro-1H-inden-5-yl)-N-methylsulfonylmethanesulfonamide Traditional Name: N-(1-cyano-6-phenoxy-indan-5-yl)-N-mesyl-methanesulfonamide Formula: C18H18N2O5S2 MolecularWeight: 406.47592

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)N(C1=C(C=C2C(CCC2=C1)C#N)OC3=CC=CC=C3)S(=O)(=O)C

Isomeric SMILES

CS(=O)(=O)N(C1=C(C=C2C(CCC2=C1)C#N)OC3=CC=CC=C3)S(=O)(=O)C

InChI

InChI=1S/C18H18N2O5S2/c1-26(21,22)20(27(2,23)24)17-10-13-8-9-14(12-19)16(13)11-18(17)25-15-6-4-3-5-7-15/h3-7,10-11,14H,8-9H2,1-2H3