1-[4-(4-fluorophenyl)-4-oxidanylidene-butyl]-4-piperidin-1-yl-piperidine-4-carboxamide dichloride

Systemtic Name: 1-[4-(4-fluorophenyl)-4-oxidanylidene-butyl]-4-piperidin-1-yl-piperidine-4-carboxamide dichloride Openeye Name: 1-[4-(4-fluorophenyl)-4-oxo-butyl]-4-(1-piperidyl)piperidine-4-carboxamide dichloride CAS Name: 1-[4-(4-fluorophenyl)-4-oxobutyl]-4-(1-piperidinyl)-4-piperidinecarboxamide dichloride IUPAC Name: 1-[4-(4-fluorophenyl)-4-oxobutyl]-4-piperidin-1-ylpiperidine-4-carboxamide dichloride Traditional Name: 1-[4-(4-fluorophenyl)-4-keto-butyl]-4-piperidino-isonipecotamide dichloride Formula: C42H60Cl2F2N6O4-2 MolecularWeight: 821.866406

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C2(CCN(CC2)CCCC(=O)C3=CC=C(C=C3)F)C(=O)N.C1CCN(CC1)C2(CCN(CC2)CCCC(=O)C3=CC=C(C=C3)F)C(=O)N.[Cl-].[Cl-]

Isomeric SMILES

C1CCN(CC1)C2(CCN(CC2)CCCC(=O)C3=CC=C(C=C3)F)C(=O)N.C1CCN(CC1)C2(CCN(CC2)CCCC(=O)C3=CC=C(C=C3)F)C(=O)N.[Cl-].[Cl-]

InChI

InChI=1S/2C21H30FN3O2.2ClH/c2*22-18-8-6-17(7-9-18)19(26)5-4-12-24-15-10-21(11-16-24,20(23)27)25-13-2-1-3-14-25;;/h2*6-9H,1-5,10-16H2,(H2,23,27);2*1H/p-2