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

Systemtic Name: N-[2-(dimethylamino)-2-(2-methoxyphenyl)ethyl]-4-imidazol-1-yl-3-nitro-benzamide Openeye Name: N-[2-(dimethylamino)-2-(2-methoxyphenyl)ethyl]-4-imidazol-1-yl-3-nitro-benzamide CAS Name: N-[2-(dimethylamino)-2-(2-methoxyphenyl)ethyl]-4-(1-imidazolyl)-3-nitrobenzamide IUPAC Name: N-[2-(dimethylamino)-2-(2-methoxyphenyl)ethyl]-4-imidazol-1-yl-3-nitrobenzamide Traditional Name: N-[2-(dimethylamino)-2-(2-methoxyphenyl)ethyl]-4-imidazol-1-yl-3-nitro-benzamide Formula: C21H23N5O4 MolecularWeight: 409.43842

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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=C3OC

Isomeric SMILES

CN(C)C(CNC(=O)C1=CC(=C(C=C1)N2C=CN=C2)[N+](=O)[O-])C3=CC=CC=C3OC

InChI

InChI=1S/C21H23N5O4/c1-24(2)19(16-6-4-5-7-20(16)30-3)13-23-21(27)15-8-9-17(18(12-15)26(28)29)25-11-10-22-14-25/h4-12,14,19H,13H2,1-3H3,(H,23,27)