4-(3,4-dihydro-2H-chromen-4-ylamino)-N-methyl-3-nitro-benzenesulfonamide

Systemtic Name: 4-(3,4-dihydro-2H-chromen-4-ylamino)-N-methyl-3-nitro-benzenesulfonamide Openeye Name: 4-(chroman-4-ylamino)-N-methyl-3-nitro-benzenesulfonamide CAS Name: 4-(3,4-dihydro-2H-1-benzopyran-4-ylamino)-N-methyl-3-nitrobenzenesulfonamide IUPAC Name: 4-(3,4-dihydro-2H-chromen-4-ylamino)-N-methyl-3-nitrobenzenesulfonamide Traditional Name: 4-(chroman-4-ylamino)-N-methyl-3-nitro-benzenesulfonamide Formula: C16H17N3O5S MolecularWeight: 363.38828

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Descriptors Computed from Structure

Canonical SMILES:

CNS(=O)(=O)C1=CC(=C(C=C1)NC2CCOC3=CC=CC=C23)[N+](=O)[O-]

Isomeric SMILES

CNS(=O)(=O)C1=CC(=C(C=C1)NC2CCOC3=CC=CC=C23)[N+](=O)[O-]

InChI

InChI=1S/C16H17N3O5S/c1-17-25(22,23)11-6-7-14(15(10-11)19(20)21)18-13-8-9-24-16-5-3-2-4-12(13)16/h2-7,10,13,17-18H,8-9H2,1H3