1-[2-oxidanylidene-2-[2-(4-propan-2-ylphenyl)ethylamino]ethyl]-N-phenyl-piperidin-1-ium-4-carboxamide

Systemtic Name: 1-[2-oxidanylidene-2-[2-(4-propan-2-ylphenyl)ethylamino]ethyl]-N-phenyl-piperidin-1-ium-4-carboxamide Openeye Name: 1-[2-[2-(4-isopropylphenyl)ethylamino]-2-oxo-ethyl]-N-phenyl-piperidin-1-ium-4-carboxamide CAS Name: 1-[2-oxo-2-[2-(4-propan-2-ylphenyl)ethylamino]ethyl]-N-phenyl-4-piperidin-1-iumcarboxamide IUPAC Name: 1-[2-oxo-2-[2-(4-propan-2-ylphenyl)ethylamino]ethyl]-N-phenylpiperidin-1-ium-4-carboxamide Traditional Name: 1-[2-keto-2-(2-p-cumenylethylamino)ethyl]-N-phenyl-piperidin-1-ium-4-carboxamide Formula: C25H34N3O2+ MolecularWeight: 408.55636

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)CCNC(=O)C[NH+]2CCC(CC2)C(=O)NC3=CC=CC=C3

Isomeric SMILES

CC(C)C1=CC=C(C=C1)CCNC(=O)C[NH+]2CCC(CC2)C(=O)NC3=CC=CC=C3

InChI

InChI=1S/C25H33N3O2/c1-19(2)21-10-8-20(9-11-21)12-15-26-24(29)18-28-16-13-22(14-17-28)25(30)27-23-6-4-3-5-7-23/h3-11,19,22H,12-18H2,1-2H3,(H,26,29)(H,27,30)/p+1