(1-morpholin-4-ylcyclopentyl)methyl-[1-[4-(pyridin-3-ylmethylcarbamoyl)phenyl]piperidin-4-yl]azanium

Systemtic Name: (1-morpholin-4-ylcyclopentyl)methyl-[1-[4-(pyridin-3-ylmethylcarbamoyl)phenyl]piperidin-4-yl]azanium Openeye Name: (1-morpholinocyclopentyl)methyl-[1-[4-(3-pyridylmethylcarbamoyl)phenyl]-4-piperidyl]ammonium CAS Name: [1-(4-morpholinyl)cyclopentyl]methyl-[1-[4-[oxo-(3-pyridinylmethylamino)methyl]phenyl]-4-piperidinyl]ammonium IUPAC Name: (1-morpholin-4-ylcyclopentyl)methyl-[1-[4-(pyridin-3-ylmethylcarbamoyl)phenyl]piperidin-4-yl]azanium Traditional Name: (1-morpholinocyclopentyl)methyl-[1-[4-(3-pyridylmethylcarbamoyl)phenyl]-4-piperidyl]ammonium Formula: C28H40N5O2+ MolecularWeight: 478.6495

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)(C[NH2+]C2CCN(CC2)C3=CC=C(C=C3)C(=O)NCC4=CN=CC=C4)N5CCOCC5

Isomeric SMILES

C1CCC(C1)(C[NH2+]C2CCN(CC2)C3=CC=C(C=C3)C(=O)NCC4=CN=CC=C4)N5CCOCC5

InChI

InChI=1S/C28H39N5O2/c34-27(30-21-23-4-3-13-29-20-23)24-5-7-26(8-6-24)32-14-9-25(10-15-32)31-22-28(11-1-2-12-28)33-16-18-35-19-17-33/h3-8,13,20,25,31H,1-2,9-12,14-19,21-22H2,(H,30,34)/p+1