3-[1-[5-(2-chlorophenyl)-2-(3-nitrophenyl)pyrazol-3-yl]carbonylpiperidin-4-yl]-1H-benzimidazol-2-one

Systemtic Name: 3-[1-[5-(2-chlorophenyl)-2-(3-nitrophenyl)pyrazol-3-yl]carbonylpiperidin-4-yl]-1H-benzimidazol-2-one Openeye Name: 3-[1-[5-(2-chlorophenyl)-2-(3-nitrophenyl)pyrazole-3-carbonyl]-4-piperidyl]-1H-benzimidazol-2-one CAS Name: 3-[1-[[5-(2-chlorophenyl)-2-(3-nitrophenyl)-3-pyrazolyl]-oxomethyl]-4-piperidinyl]-1H-benzimidazol-2-one IUPAC Name: 3-[1-[5-(2-chlorophenyl)-2-(3-nitrophenyl)pyrazole-3-carbonyl]piperidin-4-yl]-1H-benzimidazol-2-one Traditional Name: 3-[1-[5-(2-chlorophenyl)-2-(3-nitrophenyl)pyrazole-3-carbonyl]-4-piperidyl]-1H-benzimidazol-2-one Formula: C28H23ClN6O4 MolecularWeight: 542.97302

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1N2C3=CC=CC=C3NC2=O)C(=O)C4=CC(=NN4C5=CC(=CC=C5)[N+](=O)[O-])C6=CC=CC=C6Cl

Isomeric SMILES

C1CN(CCC1N2C3=CC=CC=C3NC2=O)C(=O)C4=CC(=NN4C5=CC(=CC=C5)[N+](=O)[O-])C6=CC=CC=C6Cl

InChI

InChI=1S/C28H23ClN6O4/c29-22-9-2-1-8-21(22)24-17-26(34(31-24)19-6-5-7-20(16-19)35(38)39)27(36)32-14-12-18(13-15-32)33-25-11-4-3-10-23(25)30-28(33)37/h1-11,16-18H,12-15H2,(H,30,37)