1-[(2S)-3-[bis(4-methoxyphenyl)methoxy]-2-oxidanyl-propyl]piperidin-1-ium-4-carboxamide

Systemtic Name: 1-[(2S)-3-[bis(4-methoxyphenyl)methoxy]-2-oxidanyl-propyl]piperidin-1-ium-4-carboxamide Openeye Name: 1-[(2S)-3-[bis(4-methoxyphenyl)methoxy]-2-hydroxy-propyl]piperidin-1-ium-4-carboxamide CAS Name: 1-[(2S)-3-[bis(4-methoxyphenyl)methoxy]-2-hydroxypropyl]-4-piperidin-1-iumcarboxamide IUPAC Name: 1-[(2S)-3-[bis(4-methoxyphenyl)methoxy]-2-hydroxypropyl]piperidin-1-ium-4-carboxamide Traditional Name: 1-[(2S)-3-[bis(4-methoxyphenyl)methoxy]-2-hydroxy-propyl]piperidin-1-ium-4-carboxamide Formula: C24H33N2O5+ MolecularWeight: 429.52922

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C(C2=CC=C(C=C2)OC)OCC(C[NH+]3CCC(CC3)C(=O)N)O

Isomeric SMILES

COC1=CC=C(C=C1)C(C2=CC=C(C=C2)OC)OC[C@H](C[NH+]3CCC(CC3)C(=O)N)O

InChI

InChI=1S/C24H32N2O5/c1-29-21-7-3-17(4-8-21)23(18-5-9-22(30-2)10-6-18)31-16-20(27)15-26-13-11-19(12-14-26)24(25)28/h3-10,19-20,23,27H,11-16H2,1-2H3,(H2,25,28)/p+1/t20-/m0/s1