N-[2-(2-diethylaminoethyl)-1-methyl-benzimidazol-5-yl]-3-nitro-benzamide

Systemtic Name: N-[2-(2-diethylaminoethyl)-1-methyl-benzimidazol-5-yl]-3-nitro-benzamide Openeye Name: N-[2-(2-diethylaminoethyl)-1-methyl-benzimidazol-5-yl]-3-nitro-benzamide CAS Name: N-[2-(2-diethylaminoethyl)-1-methyl-5-benzimidazolyl]-3-nitrobenzamide IUPAC Name: N-[2-(2-diethylaminoethyl)-1-methylbenzimidazol-5-yl]-3-nitrobenzamide Traditional Name: N-[2-(2-diethylaminoethyl)-1-methyl-benzimidazol-5-yl]-3-nitro-benzamide Formula: C21H25N5O3 MolecularWeight: 395.4549

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CCC1=NC2=C(N1C)C=CC(=C2)NC(=O)C3=CC(=CC=C3)[N+](=O)[O-]

Isomeric SMILES

CCN(CC)CCC1=NC2=C(N1C)C=CC(=C2)NC(=O)C3=CC(=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C21H25N5O3/c1-4-25(5-2)12-11-20-23-18-14-16(9-10-19(18)24(20)3)22-21(27)15-7-6-8-17(13-15)26(28)29/h6-10,13-14H,4-5,11-12H2,1-3H3,(H,22,27)