1-[(3S)-1,1-bis(oxidanylidene)thiolan-3-yl]-N-(4-phenylmethoxyphenyl)piperidin-1-ium-4-carboxamide

Systemtic Name: 1-[(3S)-1,1-bis(oxidanylidene)thiolan-3-yl]-N-(4-phenylmethoxyphenyl)piperidin-1-ium-4-carboxamide Openeye Name: N-(4-benzyloxyphenyl)-1-[(3S)-1,1-dioxothiolan-3-yl]piperidin-1-ium-4-carboxamide CAS Name: 1-[(3S)-1,1-dioxo-3-thiolanyl]-N-(4-phenylmethoxyphenyl)-4-piperidin-1-iumcarboxamide IUPAC Name: 1-[(3S)-1,1-dioxothiolan-3-yl]-N-(4-phenylmethoxyphenyl)piperidin-1-ium-4-carboxamide Traditional Name: N-(4-benzoxyphenyl)-1-[(3S)-1,1-diketothiolan-3-yl]piperidin-1-ium-4-carboxamide Formula: C23H29N2O4S+ MolecularWeight: 429.55236

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CCC1C(=O)NC2=CC=C(C=C2)OCC3=CC=CC=C3)C4CCS(=O)(=O)C4

Isomeric SMILES

C1CS(=O)(=O)C[C@H]1[NH+]2CCC(CC2)C(=O)NC3=CC=C(C=C3)OCC4=CC=CC=C4

InChI

InChI=1S/C23H28N2O4S/c26-23(19-10-13-25(14-11-19)21-12-15-30(27,28)17-21)24-20-6-8-22(9-7-20)29-16-18-4-2-1-3-5-18/h1-9,19,21H,10-17H2,(H,24,26)/p+1/t21-/m0/s1