[(2R)-3-(2-methoxy-4-methoxycarbonyl-phenoxy)-2-oxidanyl-propyl]-[(2R)-1-oxidanylbutan-2-yl]azanium

Systemtic Name: [(2R)-3-(2-methoxy-4-methoxycarbonyl-phenoxy)-2-oxidanyl-propyl]-[(2R)-1-oxidanylbutan-2-yl]azanium Openeye Name: [(2R)-2-hydroxy-3-(2-methoxy-4-methoxycarbonyl-phenoxy)propyl]-[(1R)-1-(hydroxymethyl)propyl]ammonium CAS Name: [(2R)-1-hydroxybutan-2-yl]-[(2R)-2-hydroxy-3-(2-methoxy-4-methoxycarbonylphenoxy)propyl]ammonium IUPAC Name: [(2R)-1-hydroxybutan-2-yl]-[(2R)-2-hydroxy-3-(2-methoxy-4-methoxycarbonylphenoxy)propyl]azanium Traditional Name: [(2R)-3-(4-carbomethoxy-2-methoxy-phenoxy)-2-hydroxy-propyl]-[(1R)-1-methylolpropyl]ammonium Formula: C16H26NO6+ MolecularWeight: 328.38074

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CO)[NH2+]CC(COC1=C(C=C(C=C1)C(=O)OC)OC)O

Isomeric SMILES

CC[C@H](CO)[NH2+]C[C@H](COC1=C(C=C(C=C1)C(=O)OC)OC)O

InChI

InChI=1S/C16H25NO6/c1-4-12(9-18)17-8-13(19)10-23-14-6-5-11(16(20)22-3)7-15(14)21-2/h5-7,12-13,17-19H,4,8-10H2,1-3H3/p+1/t12-,13-/m1/s1