2-[(2S,5S,6S)-6-[(4-methoxyphenyl)methylcarbamoyl]-5-oxidanyl-oxan-2-yl]ethyl-methyl-prop-2-enyl-azanium

Systemtic Name: 2-[(2S,5S,6S)-6-[(4-methoxyphenyl)methylcarbamoyl]-5-oxidanyl-oxan-2-yl]ethyl-methyl-prop-2-enyl-azanium Openeye Name: allyl-[2-[(2S,5S,6S)-5-hydroxy-6-[(4-methoxyphenyl)methylcarbamoyl]tetrahydropyran-2-yl]ethyl]-methyl-ammonium CAS Name: 2-[(2S,5S,6S)-5-hydroxy-6-[[(4-methoxyphenyl)methylamino]-oxomethyl]-2-oxanyl]ethyl-methyl-prop-2-enylammonium IUPAC Name: 2-[(2S,5S,6S)-5-hydroxy-6-[(4-methoxyphenyl)methylcarbamoyl]oxan-2-yl]ethyl-methyl-prop-2-enylazanium Traditional Name: allyl-[2-[(2S,5S,6S)-5-hydroxy-6-(p-anisylcarbamoyl)tetrahydropyran-2-yl]ethyl]-methyl-ammonium Formula: C20H31N2O4+ MolecularWeight: 363.47114

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](CCC1CCC(C(O1)C(=O)NCC2=CC=C(C=C2)OC)O)CC=C

Isomeric SMILES

C[NH+](CC[C@@H]1CC[C@@H]([C@H](O1)C(=O)NCC2=CC=C(C=C2)OC)O)CC=C

InChI

InChI=1S/C20H30N2O4/c1-4-12-22(2)13-11-17-9-10-18(23)19(26-17)20(24)21-14-15-5-7-16(25-3)8-6-15/h4-8,17-19,23H,1,9-14H2,2-3H3,(H,21,24)/p+1/t17-,18-,19-/m0/s1