N-(4-bromanyl-3-methyl-phenyl)-2-(7-nitro-2-oxidanylidene-3-pyrrolidin-1-yl-quinoxalin-1-yl)ethanamide

Systemtic Name: N-(4-bromanyl-3-methyl-phenyl)-2-(7-nitro-2-oxidanylidene-3-pyrrolidin-1-yl-quinoxalin-1-yl)ethanamide Openeye Name: N-(4-bromo-3-methyl-phenyl)-2-(7-nitro-2-oxo-3-pyrrolidin-1-yl-quinoxalin-1-yl)acetamide CAS Name: N-(4-bromo-3-methylphenyl)-2-[7-nitro-2-oxo-3-(1-pyrrolidinyl)-1-quinoxalinyl]acetamide IUPAC Name: N-(4-bromo-3-methylphenyl)-2-(7-nitro-2-oxo-3-pyrrolidin-1-ylquinoxalin-1-yl)acetamide Traditional Name: N-(4-bromo-3-methyl-phenyl)-2-(2-keto-7-nitro-3-pyrrolidino-quinoxalin-1-yl)acetamide Formula: C21H20BrN5O4 MolecularWeight: 486.3186

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)NC(=O)CN2C3=C(C=CC(=C3)[N+](=O)[O-])N=C(C2=O)N4CCCC4)Br

Isomeric SMILES

CC1=C(C=CC(=C1)NC(=O)CN2C3=C(C=CC(=C3)[N+](=O)[O-])N=C(C2=O)N4CCCC4)Br

InChI

InChI=1S/C21H20BrN5O4/c1-13-10-14(4-6-16(13)22)23-19(28)12-26-18-11-15(27(30)31)5-7-17(18)24-20(21(26)29)25-8-2-3-9-25/h4-7,10-11H,2-3,8-9,12H2,1H3,(H,23,28)