3-[1-[4-methyl-3-(5-methyl-2-nitro-phenoxy)pentyl]piperidin-4-yl]-1H-benzimidazol-2-one

Systemtic Name: 3-[1-[4-methyl-3-(5-methyl-2-nitro-phenoxy)pentyl]piperidin-4-yl]-1H-benzimidazol-2-one Openeye Name: 3-[1-[4-methyl-3-(5-methyl-2-nitro-phenoxy)pentyl]-4-piperidyl]-1H-benzimidazol-2-one CAS Name: 3-[1-[4-methyl-3-(5-methyl-2-nitrophenoxy)pentyl]-4-piperidinyl]-1H-benzimidazol-2-one IUPAC Name: 3-[1-[4-methyl-3-(5-methyl-2-nitrophenoxy)pentyl]piperidin-4-yl]-1H-benzimidazol-2-one Traditional Name: 3-[1-[4-methyl-3-(5-methyl-2-nitro-phenoxy)pentyl]-4-piperidyl]-1H-benzimidazol-2-one Formula: C25H32N4O4 MolecularWeight: 452.54598

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)[N+](=O)[O-])OC(CCN2CCC(CC2)N3C4=CC=CC=C4NC3=O)C(C)C

Isomeric SMILES

CC1=CC(=C(C=C1)[N+](=O)[O-])OC(CCN2CCC(CC2)N3C4=CC=CC=C4NC3=O)C(C)C

InChI

InChI=1S/C25H32N4O4/c1-17(2)23(33-24-16-18(3)8-9-22(24)29(31)32)12-15-27-13-10-19(11-14-27)28-21-7-5-4-6-20(21)26-25(28)30/h4-9,16-17,19,23H,10-15H2,1-3H3,(H,26,30)