[(2S)-3-(3-ethylphenoxy)-2-oxidanyl-propyl]-bis(2-methoxyethyl)azanium

Systemtic Name: [(2S)-3-(3-ethylphenoxy)-2-oxidanyl-propyl]-bis(2-methoxyethyl)azanium Openeye Name: [(2S)-3-(3-ethylphenoxy)-2-hydroxy-propyl]-bis(2-methoxyethyl)ammonium CAS Name: [(2S)-3-(3-ethylphenoxy)-2-hydroxypropyl]-bis(2-methoxyethyl)ammonium IUPAC Name: [(2S)-3-(3-ethylphenoxy)-2-hydroxypropyl]-bis(2-methoxyethyl)azanium Traditional Name: [(2S)-3-(3-ethylphenoxy)-2-hydroxy-propyl]-bis(2-methoxyethyl)ammonium Formula: C17H30NO4+ MolecularWeight: 312.4244

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=CC=C1)OCC(C[NH+](CCOC)CCOC)O

Isomeric SMILES

CCC1=CC(=CC=C1)OC[C@H](C[NH+](CCOC)CCOC)O

InChI

InChI=1S/C17H29NO4/c1-4-15-6-5-7-17(12-15)22-14-16(19)13-18(8-10-20-2)9-11-21-3/h5-7,12,16,19H,4,8-11,13-14H2,1-3H3/p+1/t16-/m0/s1