N-[1-(2-diethylaminoethyl)benzimidazol-2-yl]-4-(dimethylamino)-3-nitro-benzamide

Systemtic Name: N-[1-(2-diethylaminoethyl)benzimidazol-2-yl]-4-(dimethylamino)-3-nitro-benzamide Openeye Name: N-[1-(2-diethylaminoethyl)benzimidazol-2-yl]-4-(dimethylamino)-3-nitro-benzamide CAS Name: N-[1-(2-diethylaminoethyl)-2-benzimidazolyl]-4-(dimethylamino)-3-nitrobenzamide IUPAC Name: N-[1-(2-diethylaminoethyl)benzimidazol-2-yl]-4-(dimethylamino)-3-nitrobenzamide Traditional Name: N-[1-(2-diethylaminoethyl)benzimidazol-2-yl]-4-(dimethylamino)-3-nitro-benzamide Formula: C22H28N6O3 MolecularWeight: 424.49612

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CCN1C2=CC=CC=C2N=C1NC(=O)C3=CC(=C(C=C3)N(C)C)[N+](=O)[O-]

Isomeric SMILES

CCN(CC)CCN1C2=CC=CC=C2N=C1NC(=O)C3=CC(=C(C=C3)N(C)C)[N+](=O)[O-]

InChI

InChI=1S/C22H28N6O3/c1-5-26(6-2)13-14-27-18-10-8-7-9-17(18)23-22(27)24-21(29)16-11-12-19(25(3)4)20(15-16)28(30)31/h7-12,15H,5-6,13-14H2,1-4H3,(H,23,24,29)