N-[2-(2-diethylaminoethyl)-1-methyl-benzimidazol-5-yl]-2-(4-nitrophenoxy)ethanamide

Systemtic Name: N-[2-(2-diethylaminoethyl)-1-methyl-benzimidazol-5-yl]-2-(4-nitrophenoxy)ethanamide Openeye Name: N-[2-(2-diethylaminoethyl)-1-methyl-benzimidazol-5-yl]-2-(4-nitrophenoxy)acetamide CAS Name: N-[2-(2-diethylaminoethyl)-1-methyl-5-benzimidazolyl]-2-(4-nitrophenoxy)acetamide IUPAC Name: N-[2-(2-diethylaminoethyl)-1-methylbenzimidazol-5-yl]-2-(4-nitrophenoxy)acetamide Traditional Name: N-[2-(2-diethylaminoethyl)-1-methyl-benzimidazol-5-yl]-2-(4-nitrophenoxy)acetamide Formula: C22H27N5O4 MolecularWeight: 425.48088

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CCC1=NC2=C(N1C)C=CC(=C2)NC(=O)COC3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

CCN(CC)CCC1=NC2=C(N1C)C=CC(=C2)NC(=O)COC3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C22H27N5O4/c1-4-26(5-2)13-12-21-24-19-14-16(6-11-20(19)25(21)3)23-22(28)15-31-18-9-7-17(8-10-18)27(29)30/h6-11,14H,4-5,12-13,15H2,1-3H3,(H,23,28)