N-[1-ethyl-2-[(4-ethylpiperazin-1-yl)methyl]benzimidazol-5-yl]-3-nitro-benzamide

Systemtic Name: N-[1-ethyl-2-[(4-ethylpiperazin-1-yl)methyl]benzimidazol-5-yl]-3-nitro-benzamide Openeye Name: N-[1-ethyl-2-[(4-ethylpiperazin-1-yl)methyl]benzimidazol-5-yl]-3-nitro-benzamide CAS Name: N-[1-ethyl-2-[(4-ethyl-1-piperazinyl)methyl]-5-benzimidazolyl]-3-nitrobenzamide IUPAC Name: N-[1-ethyl-2-[(4-ethylpiperazin-1-yl)methyl]benzimidazol-5-yl]-3-nitrobenzamide Traditional Name: N-[1-ethyl-2-[(4-ethylpiperazino)methyl]benzimidazol-5-yl]-3-nitro-benzamide Formula: C23H28N6O3 MolecularWeight: 436.50682

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN1CCN(CC1)CC2=NC3=C(N2CC)C=CC(=C3)NC(=O)C4=CC(=CC=C4)[N+](=O)[O-]

Isomeric SMILES

CCN1CCN(CC1)CC2=NC3=C(N2CC)C=CC(=C3)NC(=O)C4=CC(=CC=C4)[N+](=O)[O-]

InChI

InChI=1S/C23H28N6O3/c1-3-26-10-12-27(13-11-26)16-22-25-20-15-18(8-9-21(20)28(22)4-2)24-23(30)17-6-5-7-19(14-17)29(31)32/h5-9,14-15H,3-4,10-13,16H2,1-2H3,(H,24,30)