N-ethyl-N-[(1R)-1-[1-[(4-ethylphenyl)methyl]piperidin-1-ium-4-yl]-2-phenyl-ethyl]oxane-4-carboxamide

Systemtic Name: N-ethyl-N-[(1R)-1-[1-[(4-ethylphenyl)methyl]piperidin-1-ium-4-yl]-2-phenyl-ethyl]oxane-4-carboxamide Openeye Name: N-ethyl-N-[(1R)-1-[1-[(4-ethylphenyl)methyl]piperidin-1-ium-4-yl]-2-phenyl-ethyl]tetrahydropyran-4-carboxamide CAS Name: N-ethyl-N-[(1R)-1-[1-[(4-ethylphenyl)methyl]-4-piperidin-1-iumyl]-2-phenylethyl]-4-oxanecarboxamide IUPAC Name: N-ethyl-N-[(1R)-1-[1-[(4-ethylphenyl)methyl]piperidin-1-ium-4-yl]-2-phenylethyl]oxane-4-carboxamide Traditional Name: N-ethyl-N-[(1R)-1-[1-(4-ethylbenzyl)piperidin-1-ium-4-yl]-2-phenyl-ethyl]tetrahydropyran-4-carboxamide Formula: C30H43N2O2+ MolecularWeight: 463.67462

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C[NH+]2CCC(CC2)C(CC3=CC=CC=C3)N(CC)C(=O)C4CCOCC4

Isomeric SMILES

CCC1=CC=C(C=C1)C[NH+]2CCC(CC2)[C@@H](CC3=CC=CC=C3)N(CC)C(=O)C4CCOCC4

InChI

InChI=1S/C30H42N2O2/c1-3-24-10-12-26(13-11-24)23-31-18-14-27(15-19-31)29(22-25-8-6-5-7-9-25)32(4-2)30(33)28-16-20-34-21-17-28/h5-13,27-29H,3-4,14-23H2,1-2H3/p+1/t29-/m1/s1