[4-[(2-chlorophenyl)methoxy]-3-ethoxy-phenyl]methyl-[(2R)-1-oxidanylbutan-2-yl]azanium

Systemtic Name: [4-[(2-chlorophenyl)methoxy]-3-ethoxy-phenyl]methyl-[(2R)-1-oxidanylbutan-2-yl]azanium Openeye Name: [4-[(2-chlorophenyl)methoxy]-3-ethoxy-phenyl]methyl-[(1R)-1-(hydroxymethyl)propyl]ammonium CAS Name: [4-[(2-chlorophenyl)methoxy]-3-ethoxyphenyl]methyl-[(2R)-1-hydroxybutan-2-yl]ammonium IUPAC Name: [4-[(2-chlorophenyl)methoxy]-3-ethoxyphenyl]methyl-[(2R)-1-hydroxybutan-2-yl]azanium Traditional Name: [4-(2-chlorobenzyl)oxy-3-ethoxy-benzyl]-[(1R)-1-methylolpropyl]ammonium Formula: C20H27ClNO3+ MolecularWeight: 364.88628

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CO)[NH2+]CC1=CC(=C(C=C1)OCC2=CC=CC=C2Cl)OCC

Isomeric SMILES

CC[C@H](CO)[NH2+]CC1=CC(=C(C=C1)OCC2=CC=CC=C2Cl)OCC

InChI

InChI=1S/C20H26ClNO3/c1-3-17(13-23)22-12-15-9-10-19(20(11-15)24-4-2)25-14-16-7-5-6-8-18(16)21/h5-11,17,22-23H,3-4,12-14H2,1-2H3/p+1/t17-/m1/s1