N-(2-morpholin-4-ium-4-ylethyl)-4-[4-(4-pyrimidin-2-ylpiperazin-1-ium-1-yl)piperidin-1-yl]benzamide

Systemtic Name: N-(2-morpholin-4-ium-4-ylethyl)-4-[4-(4-pyrimidin-2-ylpiperazin-1-ium-1-yl)piperidin-1-yl]benzamide Openeye Name: N-(2-morpholin-4-ium-4-ylethyl)-4-[4-(4-pyrimidin-2-ylpiperazin-1-ium-1-yl)-1-piperidyl]benzamide CAS Name: N-[2-(4-morpholin-4-iumyl)ethyl]-4-[4-[4-(2-pyrimidinyl)-1-piperazin-1-iumyl]-1-piperidinyl]benzamide IUPAC Name: N-(2-morpholin-4-ium-4-ylethyl)-4-[4-(4-pyrimidin-2-ylpiperazin-1-ium-1-yl)piperidin-1-yl]benzamide Traditional Name: N-(2-morpholin-4-ium-4-ylethyl)-4-[4-[4-(2-pyrimidyl)piperazin-1-ium-1-yl]piperidino]benzamide Formula: C26H39N7O2+2 MolecularWeight: 481.63356

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1[NH+]2CCN(CC2)C3=NC=CC=N3)C4=CC=C(C=C4)C(=O)NCC[NH+]5CCOCC5

Isomeric SMILES

C1CN(CCC1[NH+]2CCN(CC2)C3=NC=CC=N3)C4=CC=C(C=C4)C(=O)NCC[NH+]5CCOCC5

InChI

InChI=1S/C26H37N7O2/c34-25(27-10-13-30-18-20-35-21-19-30)22-2-4-23(5-3-22)31-11-6-24(7-12-31)32-14-16-33(17-15-32)26-28-8-1-9-29-26/h1-5,8-9,24H,6-7,10-21H2,(H,27,34)/p+2