4-[[2-(4-methylphenyl)-2-oxidanylidene-ethyl]-(4-nitrophenyl)sulfonyl-amino]butanamide

Systemtic Name: 4-[[2-(4-methylphenyl)-2-oxidanylidene-ethyl]-(4-nitrophenyl)sulfonyl-amino]butanamide Openeye Name: 4-[(4-nitrophenyl)sulfonyl-[2-oxo-2-(p-tolyl)ethyl]amino]butanamide CAS Name: 4-[[2-(4-methylphenyl)-2-oxoethyl]-(4-nitrophenyl)sulfonylamino]butanamide IUPAC Name: 4-[[2-(4-methylphenyl)-2-oxoethyl]-(4-nitrophenyl)sulfonylamino]butanamide Traditional Name: 4-[[2-keto-2-(p-tolyl)ethyl]-nosyl-amino]butyramide Formula: C19H21N3O6S MolecularWeight: 419.45154

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)CN(CCCC(=O)N)S(=O)(=O)C2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)CN(CCCC(=O)N)S(=O)(=O)C2=CC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C19H21N3O6S/c1-14-4-6-15(7-5-14)18(23)13-21(12-2-3-19(20)24)29(27,28)17-10-8-16(9-11-17)22(25)26/h4-11H,2-3,12-13H2,1H3,(H2,20,24)