N-[2-[(4-bromanyl-2-methyl-phenyl)amino]-2-oxidanylidene-ethyl]-4-imidazol-1-yl-3-nitro-benzamide

Systemtic Name: N-[2-[(4-bromanyl-2-methyl-phenyl)amino]-2-oxidanylidene-ethyl]-4-imidazol-1-yl-3-nitro-benzamide Openeye Name: N-[2-(4-bromo-2-methyl-anilino)-2-oxo-ethyl]-4-imidazol-1-yl-3-nitro-benzamide CAS Name: N-[2-(4-bromo-2-methylanilino)-2-oxoethyl]-4-(1-imidazolyl)-3-nitrobenzamide IUPAC Name: N-[2-(4-bromo-2-methylanilino)-2-oxoethyl]-4-imidazol-1-yl-3-nitrobenzamide Traditional Name: N-[2-(4-bromo-2-methyl-anilino)-2-keto-ethyl]-4-imidazol-1-yl-3-nitro-benzamide Formula: C19H16BrN5O4 MolecularWeight: 458.26544

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)Br)NC(=O)CNC(=O)C2=CC(=C(C=C2)N3C=CN=C3)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=CC(=C1)Br)NC(=O)CNC(=O)C2=CC(=C(C=C2)N3C=CN=C3)[N+](=O)[O-]

InChI

InChI=1S/C19H16BrN5O4/c1-12-8-14(20)3-4-15(12)23-18(26)10-22-19(27)13-2-5-16(17(9-13)25(28)29)24-7-6-21-11-24/h2-9,11H,10H2,1H3,(H,22,27)(H,23,26)