4-[2-(4-methyl-2-oxidanylidene-3,4-dihydro-1H-1,5-benzodiazepin-5-yl)-2-oxidanylidene-ethoxy]-3-nitro-benzenesulfonamide

Systemtic Name: 4-[2-(4-methyl-2-oxidanylidene-3,4-dihydro-1H-1,5-benzodiazepin-5-yl)-2-oxidanylidene-ethoxy]-3-nitro-benzenesulfonamide Openeye Name: 4-[2-(4-methyl-2-oxo-3,4-dihydro-1H-1,5-benzodiazepin-5-yl)-2-oxo-ethoxy]-3-nitro-benzenesulfonamide CAS Name: 4-[2-(4-methyl-2-oxo-3,4-dihydro-1H-1,5-benzodiazepin-5-yl)-2-oxoethoxy]-3-nitrobenzenesulfonamide IUPAC Name: 4-[2-(4-methyl-2-oxo-3,4-dihydro-1H-1,5-benzodiazepin-5-yl)-2-oxoethoxy]-3-nitrobenzenesulfonamide Traditional Name: 4-[2-keto-2-(2-keto-4-methyl-3,4-dihydro-1H-1,5-benzodiazepin-5-yl)ethoxy]-3-nitro-benzenesulfonamide Formula: C18H18N4O7S MolecularWeight: 434.42312

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC(=O)NC2=CC=CC=C2N1C(=O)COC3=C(C=C(C=C3)S(=O)(=O)N)[N+](=O)[O-]

Isomeric SMILES

CC1CC(=O)NC2=CC=CC=C2N1C(=O)COC3=C(C=C(C=C3)S(=O)(=O)N)[N+](=O)[O-]

InChI

InChI=1S/C18H18N4O7S/c1-11-8-17(23)20-13-4-2-3-5-14(13)21(11)18(24)10-29-16-7-6-12(30(19,27)28)9-15(16)22(25)26/h2-7,9,11H,8,10H2,1H3,(H,20,23)(H2,19,27,28)