diethyl-[(2S)-3-[4-[[(4-ethylphenyl)methyl-methyl-azaniumyl]methyl]-2-methoxy-phenoxy]-2-oxidanyl-propyl]azanium

Systemtic Name: diethyl-[(2S)-3-[4-[[(4-ethylphenyl)methyl-methyl-azaniumyl]methyl]-2-methoxy-phenoxy]-2-oxidanyl-propyl]azanium Openeye Name: diethyl-[(2S)-3-[4-[[(4-ethylphenyl)methyl-methyl-ammonio]methyl]-2-methoxy-phenoxy]-2-hydroxy-propyl]ammonium CAS Name: diethyl-[(2S)-3-[4-[[(4-ethylphenyl)methyl-methylammonio]methyl]-2-methoxyphenoxy]-2-hydroxypropyl]ammonium IUPAC Name: diethyl-[(2S)-3-[4-[[(4-ethylphenyl)methyl-methylazaniumyl]methyl]-2-methoxyphenoxy]-2-hydroxypropyl]azanium Traditional Name: diethyl-[(2S)-3-[4-[[(4-ethylbenzyl)-methyl-ammonio]methyl]-2-methoxy-phenoxy]-2-hydroxy-propyl]ammonium Formula: C25H40N2O3+2 MolecularWeight: 416.5967

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C[NH+](C)CC2=CC(=C(C=C2)OCC(C[NH+](CC)CC)O)OC

Isomeric SMILES

CCC1=CC=C(C=C1)C[NH+](C)CC2=CC(=C(C=C2)OC[C@H](C[NH+](CC)CC)O)OC

InChI

InChI=1S/C25H38N2O3/c1-6-20-9-11-21(12-10-20)16-26(4)17-22-13-14-24(25(15-22)29-5)30-19-23(28)18-27(7-2)8-3/h9-15,23,28H,6-8,16-19H2,1-5H3/p+2/t23-/m0/s1