(2-methyl-2-morpholin-4-yl-propyl)-[1-[4-(pyridin-3-ylmethylcarbamoyl)phenyl]piperidin-4-yl]azanium

Systemtic Name: (2-methyl-2-morpholin-4-yl-propyl)-[1-[4-(pyridin-3-ylmethylcarbamoyl)phenyl]piperidin-4-yl]azanium Openeye Name: (2-methyl-2-morpholino-propyl)-[1-[4-(3-pyridylmethylcarbamoyl)phenyl]-4-piperidyl]ammonium CAS Name: [2-methyl-2-(4-morpholinyl)propyl]-[1-[4-[oxo-(3-pyridinylmethylamino)methyl]phenyl]-4-piperidinyl]ammonium IUPAC Name: (2-methyl-2-morpholin-4-ylpropyl)-[1-[4-(pyridin-3-ylmethylcarbamoyl)phenyl]piperidin-4-yl]azanium Traditional Name: (2-methyl-2-morpholino-propyl)-[1-[4-(3-pyridylmethylcarbamoyl)phenyl]-4-piperidyl]ammonium Formula: C26H38N5O2+ MolecularWeight: 452.61222

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C[NH2+]C1CCN(CC1)C2=CC=C(C=C2)C(=O)NCC3=CN=CC=C3)N4CCOCC4

Isomeric SMILES

CC(C)(C[NH2+]C1CCN(CC1)C2=CC=C(C=C2)C(=O)NCC3=CN=CC=C3)N4CCOCC4

InChI

InChI=1S/C26H37N5O2/c1-26(2,31-14-16-33-17-15-31)20-29-23-9-12-30(13-10-23)24-7-5-22(6-8-24)25(32)28-19-21-4-3-11-27-18-21/h3-8,11,18,23,29H,9-10,12-17,19-20H2,1-2H3,(H,28,32)/p+1