6-(1-oxidanidylpyridin-1-ium-4-yl)carbonyl-N-[(4-phenyloxan-4-yl)methyl]-6-azaspiro[2.5]octane-2-carboxamide

Systemtic Name: 6-(1-oxidanidylpyridin-1-ium-4-yl)carbonyl-N-[(4-phenyloxan-4-yl)methyl]-6-azaspiro[2.5]octane-2-carboxamide Openeye Name: 6-(1-oxidopyridin-1-ium-4-carbonyl)-N-[(4-phenyltetrahydropyran-4-yl)methyl]-6-azaspiro[2.5]octane-2-carboxamide CAS Name: 6-[(1-oxido-4-pyridin-1-iumyl)-oxomethyl]-N-[(4-phenyl-4-oxanyl)methyl]-6-azaspiro[2.5]octane-2-carboxamide IUPAC Name: 6-(1-oxidopyridin-1-ium-4-carbonyl)-N-[(4-phenyloxan-4-yl)methyl]-6-azaspiro[2.5]octane-2-carboxamide Traditional Name: 6-(1-oxidopyridin-1-ium-4-carbonyl)-N-[(4-phenyltetrahydropyran-4-yl)methyl]-6-azaspiro[2.5]octane-2-carboxamide Formula: C26H31N3O4 MolecularWeight: 449.54204

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC12CC2C(=O)NCC3(CCOCC3)C4=CC=CC=C4)C(=O)C5=CC=[N+](C=C5)[O-]

Isomeric SMILES

C1CN(CCC12CC2C(=O)NCC3(CCOCC3)C4=CC=CC=C4)C(=O)C5=CC=[N+](C=C5)[O-]

InChI

InChI=1S/C26H31N3O4/c30-23(27-19-26(10-16-33-17-11-26)21-4-2-1-3-5-21)22-18-25(22)8-14-28(15-9-25)24(31)20-6-12-29(32)13-7-20/h1-7,12-13,22H,8-11,14-19H2,(H,27,30)