methyl-[(2S)-2-oxidanyl-3-(2-propan-2-ylphenoxy)propyl]-[(4-prop-2-enoxyphenyl)methyl]azanium

Systemtic Name: methyl-[(2S)-2-oxidanyl-3-(2-propan-2-ylphenoxy)propyl]-[(4-prop-2-enoxyphenyl)methyl]azanium Openeye Name: (4-allyloxyphenyl)methyl-[(2S)-2-hydroxy-3-(2-isopropylphenoxy)propyl]-methyl-ammonium CAS Name: [(2S)-2-hydroxy-3-(2-propan-2-ylphenoxy)propyl]-methyl-[(4-prop-2-enoxyphenyl)methyl]ammonium IUPAC Name: [(2S)-2-hydroxy-3-(2-propan-2-ylphenoxy)propyl]-methyl-[(4-prop-2-enoxyphenyl)methyl]azanium Traditional Name: (4-allyloxybenzyl)-[(2S)-2-hydroxy-3-(2-isopropylphenoxy)propyl]-methyl-ammonium Formula: C23H32NO3+ MolecularWeight: 370.50508

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=CC=C1OCC(C[NH+](C)CC2=CC=C(C=C2)OCC=C)O

Isomeric SMILES

CC(C)C1=CC=CC=C1OC[C@H](C[NH+](C)CC2=CC=C(C=C2)OCC=C)O

InChI

InChI=1S/C23H31NO3/c1-5-14-26-21-12-10-19(11-13-21)15-24(4)16-20(25)17-27-23-9-7-6-8-22(23)18(2)3/h5-13,18,20,25H,1,14-17H2,2-4H3/p+1/t20-/m0/s1