[(2S)-3-(4-ethoxycarbonylphenoxy)-2-oxidanyl-propyl]-[(2R)-1-methoxypropan-2-yl]azanium

Systemtic Name: [(2S)-3-(4-ethoxycarbonylphenoxy)-2-oxidanyl-propyl]-[(2R)-1-methoxypropan-2-yl]azanium Openeye Name: [(2S)-3-(4-ethoxycarbonylphenoxy)-2-hydroxy-propyl]-[(1R)-2-methoxy-1-methyl-ethyl]ammonium CAS Name: [(2S)-3-(4-ethoxycarbonylphenoxy)-2-hydroxypropyl]-[(2R)-1-methoxypropan-2-yl]ammonium IUPAC Name: [(2S)-3-(4-ethoxycarbonylphenoxy)-2-hydroxypropyl]-[(2R)-1-methoxypropan-2-yl]azanium Traditional Name: [(2S)-3-(4-carbethoxyphenoxy)-2-hydroxy-propyl]-[(1R)-2-methoxy-1-methyl-ethyl]ammonium Formula: C16H26NO5+ MolecularWeight: 312.38134

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)OCC(C[NH2+]C(C)COC)O

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)OC[C@H](C[NH2+][C@H](C)COC)O

InChI

InChI=1S/C16H25NO5/c1-4-21-16(19)13-5-7-15(8-6-13)22-11-14(18)9-17-12(2)10-20-3/h5-8,12,14,17-18H,4,9-11H2,1-3H3/p+1/t12-,14+/m1/s1