4-phenyl-N-[3-[4-(4-pyridin-3-yloxypiperidin-1-ium-1-yl)piperidin-1-yl]phenyl]butanamide

Systemtic Name: 4-phenyl-N-[3-[4-(4-pyridin-3-yloxypiperidin-1-ium-1-yl)piperidin-1-yl]phenyl]butanamide Openeye Name: 4-phenyl-N-[3-[4-[4-(3-pyridyloxy)piperidin-1-ium-1-yl]-1-piperidyl]phenyl]butanamide CAS Name: 4-phenyl-N-[3-[4-[4-(3-pyridinyloxy)-1-piperidin-1-iumyl]-1-piperidinyl]phenyl]butanamide IUPAC Name: 4-phenyl-N-[3-[4-(4-pyridin-3-yloxypiperidin-1-ium-1-yl)piperidin-1-yl]phenyl]butanamide Traditional Name: 4-phenyl-N-[3-[4-[4-(3-pyridyloxy)piperidin-1-ium-1-yl]piperidino]phenyl]butyramide Formula: C31H39N4O2+ MolecularWeight: 499.66696

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CCC1OC2=CN=CC=C2)C3CCN(CC3)C4=CC(=CC=C4)NC(=O)CCCC5=CC=CC=C5

Isomeric SMILES

C1C[NH+](CCC1OC2=CN=CC=C2)C3CCN(CC3)C4=CC(=CC=C4)NC(=O)CCCC5=CC=CC=C5

InChI

InChI=1S/C31H38N4O2/c36-31(13-4-9-25-7-2-1-3-8-25)33-26-10-5-11-28(23-26)35-19-14-27(15-20-35)34-21-16-29(17-22-34)37-30-12-6-18-32-24-30/h1-3,5-8,10-12,18,23-24,27,29H,4,9,13-17,19-22H2,(H,33,36)/p+1