N-(6-cyano-8-nitro-3,4-dihydro-2H-chromen-3-yl)-N-(phenylmethyl)methanesulfonamide

Systemtic Name: N-(6-cyano-8-nitro-3,4-dihydro-2H-chromen-3-yl)-N-(phenylmethyl)methanesulfonamide Openeye Name: N-benzyl-N-(6-cyano-8-nitro-chroman-3-yl)methanesulfonamide CAS Name: N-(6-cyano-8-nitro-3,4-dihydro-2H-1-benzopyran-3-yl)-N-(phenylmethyl)methanesulfonamide IUPAC Name: N-benzyl-N-(6-cyano-8-nitro-3,4-dihydro-2H-chromen-3-yl)methanesulfonamide Traditional Name: N-benzyl-N-(6-cyano-8-nitro-chroman-3-yl)methanesulfonamide Formula: C18H17N3O5S MolecularWeight: 387.40968

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)N(CC1=CC=CC=C1)C2CC3=C(C(=CC(=C3)C#N)[N+](=O)[O-])OC2

Isomeric SMILES

CS(=O)(=O)N(CC1=CC=CC=C1)C2CC3=C(C(=CC(=C3)C#N)[N+](=O)[O-])OC2

InChI

InChI=1S/C18H17N3O5S/c1-27(24,25)20(11-13-5-3-2-4-6-13)16-9-15-7-14(10-19)8-17(21(22)23)18(15)26-12-16/h2-8,16H,9,11-12H2,1H3