2-[(2S,4S)-4-(4-methoxy-3-oxidanyl-phenyl)-2-methyl-1,3-dioxolan-2-yl]ethylazanium

Systemtic Name: 2-[(2S,4S)-4-(4-methoxy-3-oxidanyl-phenyl)-2-methyl-1,3-dioxolan-2-yl]ethylazanium Openeye Name: 2-[(2S,4S)-4-(3-hydroxy-4-methoxy-phenyl)-2-methyl-1,3-dioxolan-2-yl]ethylammonium CAS Name: 2-[(2S,4S)-4-(3-hydroxy-4-methoxyphenyl)-2-methyl-1,3-dioxolan-2-yl]ethylammonium IUPAC Name: 2-[(2S,4S)-4-(3-hydroxy-4-methoxyphenyl)-2-methyl-1,3-dioxolan-2-yl]ethylazanium Traditional Name: 2-[(2S,4S)-4-(3-hydroxy-4-methoxy-phenyl)-2-methyl-1,3-dioxolan-2-yl]ethylammonium Formula: C13H20NO4+ MolecularWeight: 254.3022

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Descriptors Computed from Structure

Canonical SMILES:

CC1(OCC(O1)C2=CC(=C(C=C2)OC)O)CC[NH3+]

Isomeric SMILES

C[C@@]1(OC[C@@H](O1)C2=CC(=C(C=C2)OC)O)CC[NH3+]

InChI

InChI=1S/C13H19NO4/c1-13(5-6-14)17-8-12(18-13)9-3-4-11(16-2)10(15)7-9/h3-4,7,12,15H,5-6,8,14H2,1-2H3/p+1/t12-,13+/m1/s1