1-[2-[4-(4-fluorophenyl)carbonylpiperidin-1-yl]ethyl]-3-[(3-nitrophenyl)methyl]benzimidazol-2-one hydrochloride

Systemtic Name: 1-[2-[4-(4-fluorophenyl)carbonylpiperidin-1-yl]ethyl]-3-[(3-nitrophenyl)methyl]benzimidazol-2-one hydrochloride Openeye Name: 1-[2-[4-(4-fluorobenzoyl)-1-piperidyl]ethyl]-3-[(3-nitrophenyl)methyl]benzimidazol-2-one hydrochloride CAS Name: 1-[2-[4-[(4-fluorophenyl)-oxomethyl]-1-piperidinyl]ethyl]-3-[(3-nitrophenyl)methyl]-2-benzimidazolone hydrochloride IUPAC Name: 1-[2-[4-(4-fluorobenzoyl)piperidin-1-yl]ethyl]-3-[(3-nitrophenyl)methyl]benzimidazol-2-one hydrochloride Traditional Name: 1-[2-[4-(4-fluorobenzoyl)piperidino]ethyl]-3-(3-nitrobenzyl)benzimidazol-2-one hydrochloride Formula: C28H28ClFN4O4 MolecularWeight: 538.997723

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)C2=CC=C(C=C2)F)CCN3C4=CC=CC=C4N(C3=O)CC5=CC(=CC=C5)[N+](=O)[O-].Cl

Isomeric SMILES

C1CN(CCC1C(=O)C2=CC=C(C=C2)F)CCN3C4=CC=CC=C4N(C3=O)CC5=CC(=CC=C5)[N+](=O)[O-].Cl

InChI

InChI=1S/C28H27FN4O4.ClH/c29-23-10-8-21(9-11-23)27(34)22-12-14-30(15-13-22)16-17-31-25-6-1-2-7-26(25)32(28(31)35)19-20-4-3-5-24(18-20)33(36)37;/h1-11,18,22H,12-17,19H2;1H