3-methyl-N-(4-nitrophenyl)-1-oxidanylidene-5,6-dihydro-4H-benzo[f]quinazoline-9-sulfonamide

Systemtic Name: 3-methyl-N-(4-nitrophenyl)-1-oxidanylidene-5,6-dihydro-4H-benzo[f]quinazoline-9-sulfonamide Openeye Name: 3-methyl-N-(4-nitrophenyl)-1-oxo-5,6-dihydro-4H-benzo[f]quinazoline-9-sulfonamide CAS Name: 3-methyl-N-(4-nitrophenyl)-1-oxo-5,6-dihydro-4H-benzo[f]quinazoline-9-sulfonamide IUPAC Name: 3-methyl-N-(4-nitrophenyl)-1-oxo-5,6-dihydro-4H-benzo[f]quinazoline-9-sulfonamide Traditional Name: 1-keto-3-methyl-N-(4-nitrophenyl)-5,6-dihydro-4H-benzo[f]quinazoline-9-sulfonamide Formula: C19H16N4O5S MolecularWeight: 412.41914

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=O)C2=C(N1)CCC3=C2C=C(C=C3)S(=O)(=O)NC4=CC=C(C=C4)[N+](=O)[O-]

Isomeric SMILES

CC1=NC(=O)C2=C(N1)CCC3=C2C=C(C=C3)S(=O)(=O)NC4=CC=C(C=C4)[N+](=O)[O-]

InChI

InChI=1S/C19H16N4O5S/c1-11-20-17-9-3-12-2-8-15(10-16(12)18(17)19(24)21-11)29(27,28)22-13-4-6-14(7-5-13)23(25)26/h2,4-8,10,22H,3,9H2,1H3,(H,20,21,24)