N-(1,3-diethyl-2-oxidanylidene-6-pyrrolidin-1-yl-benzimidazol-5-yl)-4-methyl-3-nitro-benzamide

Systemtic Name: N-(1,3-diethyl-2-oxidanylidene-6-pyrrolidin-1-yl-benzimidazol-5-yl)-4-methyl-3-nitro-benzamide Openeye Name: N-(1,3-diethyl-2-oxo-6-pyrrolidin-1-yl-benzimidazol-5-yl)-4-methyl-3-nitro-benzamide CAS Name: N-[1,3-diethyl-2-oxo-6-(1-pyrrolidinyl)-5-benzimidazolyl]-4-methyl-3-nitrobenzamide IUPAC Name: N-(1,3-diethyl-2-oxo-6-pyrrolidin-1-ylbenzimidazol-5-yl)-4-methyl-3-nitrobenzamide Traditional Name: N-(1,3-diethyl-2-keto-6-pyrrolidino-benzimidazol-5-yl)-4-methyl-3-nitro-benzamide Formula: C23H27N5O4 MolecularWeight: 437.49158

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=CC(=C(C=C2N(C1=O)CC)N3CCCC3)NC(=O)C4=CC(=C(C=C4)C)[N+](=O)[O-]

Isomeric SMILES

CCN1C2=CC(=C(C=C2N(C1=O)CC)N3CCCC3)NC(=O)C4=CC(=C(C=C4)C)[N+](=O)[O-]

InChI

InChI=1S/C23H27N5O4/c1-4-26-20-13-17(24-22(29)16-9-8-15(3)18(12-16)28(31)32)19(25-10-6-7-11-25)14-21(20)27(5-2)23(26)30/h8-9,12-14H,4-7,10-11H2,1-3H3,(H,24,29)