N-[2-(2-chlorophenyl)-2-(dimethylamino)ethyl]-4-imidazol-1-yl-3-nitro-benzamide

Systemtic Name: N-[2-(2-chlorophenyl)-2-(dimethylamino)ethyl]-4-imidazol-1-yl-3-nitro-benzamide Openeye Name: N-[2-(2-chlorophenyl)-2-(dimethylamino)ethyl]-4-imidazol-1-yl-3-nitro-benzamide CAS Name: N-[2-(2-chlorophenyl)-2-(dimethylamino)ethyl]-4-(1-imidazolyl)-3-nitrobenzamide IUPAC Name: N-[2-(2-chlorophenyl)-2-(dimethylamino)ethyl]-4-imidazol-1-yl-3-nitrobenzamide Traditional Name: N-[2-(2-chlorophenyl)-2-(dimethylamino)ethyl]-4-imidazol-1-yl-3-nitro-benzamide Formula: C20H20ClN5O3 MolecularWeight: 413.8575

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C(CNC(=O)C1=CC(=C(C=C1)N2C=CN=C2)[N+](=O)[O-])C3=CC=CC=C3Cl

Isomeric SMILES

CN(C)C(CNC(=O)C1=CC(=C(C=C1)N2C=CN=C2)[N+](=O)[O-])C3=CC=CC=C3Cl

InChI

InChI=1S/C20H20ClN5O3/c1-24(2)19(15-5-3-4-6-16(15)21)12-23-20(27)14-7-8-17(18(11-14)26(28)29)25-10-9-22-13-25/h3-11,13,19H,12H2,1-2H3,(H,23,27)