N-(2,2-dimethyl-6,8-dinitro-3,4-dihydrochromen-4-yl)ethanesulfonamide

Systemtic Name: N-(2,2-dimethyl-6,8-dinitro-3,4-dihydrochromen-4-yl)ethanesulfonamide Openeye Name: N-(2,2-dimethyl-6,8-dinitro-chroman-4-yl)ethanesulfonamide CAS Name: N-(2,2-dimethyl-6,8-dinitro-3,4-dihydro-2H-1-benzopyran-4-yl)ethanesulfonamide IUPAC Name: N-(2,2-dimethyl-6,8-dinitro-3,4-dihydrochromen-4-yl)ethanesulfonamide Traditional Name: N-(2,2-dimethyl-6,8-dinitro-chroman-4-yl)ethanesulfonamide Formula: C13H17N3O7S MolecularWeight: 359.35498

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCS(=O)(=O)NC1CC(OC2=C(C=C(C=C12)[N+](=O)[O-])[N+](=O)[O-])(C)C

Isomeric SMILES

CCS(=O)(=O)NC1CC(OC2=C(C=C(C=C12)[N+](=O)[O-])[N+](=O)[O-])(C)C

InChI

InChI=1S/C13H17N3O7S/c1-4-24(21,22)14-10-7-13(2,3)23-12-9(10)5-8(15(17)18)6-11(12)16(19)20/h5-6,10,14H,4,7H2,1-3H3