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

Systemtic Name: bis(2-methoxyethyl)-[(2S)-2-oxidanyl-3-(2-propan-2-ylphenoxy)propyl]azanium Openeye Name: [(2S)-2-hydroxy-3-(2-isopropylphenoxy)propyl]-bis(2-methoxyethyl)ammonium CAS Name: [(2S)-2-hydroxy-3-(2-propan-2-ylphenoxy)propyl]-bis(2-methoxyethyl)ammonium IUPAC Name: [(2S)-2-hydroxy-3-(2-propan-2-ylphenoxy)propyl]-bis(2-methoxyethyl)azanium Traditional Name: [(2S)-2-hydroxy-3-(2-isopropylphenoxy)propyl]-bis(2-methoxyethyl)ammonium Formula: C18H32NO4+ MolecularWeight: 326.45098

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=CC=C1OCC(C[NH+](CCOC)CCOC)O

Isomeric SMILES

CC(C)C1=CC=CC=C1OC[C@H](C[NH+](CCOC)CCOC)O

InChI

InChI=1S/C18H31NO4/c1-15(2)17-7-5-6-8-18(17)23-14-16(20)13-19(9-11-21-3)10-12-22-4/h5-8,15-16,20H,9-14H2,1-4H3/p+1/t16-/m0/s1