[1-(1-oxidanidylpyridin-1-ium-4-yl)carbonylpiperidin-3-yl]-(4-phenoxyphenyl)methanone

Systemtic Name: [1-(1-oxidanidylpyridin-1-ium-4-yl)carbonylpiperidin-3-yl]-(4-phenoxyphenyl)methanone Openeye Name: [1-(1-oxidopyridin-1-ium-4-carbonyl)-3-piperidyl]-(4-phenoxyphenyl)methanone CAS Name: [1-[(1-oxido-4-pyridin-1-iumyl)-oxomethyl]-3-piperidinyl]-(4-phenoxyphenyl)methanone IUPAC Name: [1-(1-oxidopyridin-1-ium-4-carbonyl)piperidin-3-yl]-(4-phenoxyphenyl)methanone Traditional Name: [1-(1-oxidopyridin-1-ium-4-carbonyl)-3-piperidyl]-(4-phenoxyphenyl)methanone Formula: C24H22N2O4 MolecularWeight: 402.44248

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)C(=O)C2=CC=[N+](C=C2)[O-])C(=O)C3=CC=C(C=C3)OC4=CC=CC=C4

Isomeric SMILES

C1CC(CN(C1)C(=O)C2=CC=[N+](C=C2)[O-])C(=O)C3=CC=C(C=C3)OC4=CC=CC=C4

InChI

InChI=1S/C24H22N2O4/c27-23(18-8-10-22(11-9-18)30-21-6-2-1-3-7-21)20-5-4-14-25(17-20)24(28)19-12-15-26(29)16-13-19/h1-3,6-13,15-16,20H,4-5,14,17H2