[(1R)-3-ethoxy-1-(4-methylphenyl)-3-oxidanylidene-propyl]-[(3-ethoxy-2-oxidanyl-phenyl)methyl]azanium

Systemtic Name: [(1R)-3-ethoxy-1-(4-methylphenyl)-3-oxidanylidene-propyl]-[(3-ethoxy-2-oxidanyl-phenyl)methyl]azanium Openeye Name: (3-ethoxy-2-hydroxy-phenyl)methyl-[(1R)-3-ethoxy-3-oxo-1-(p-tolyl)propyl]ammonium CAS Name: (3-ethoxy-2-hydroxyphenyl)methyl-[(1R)-3-ethoxy-1-(4-methylphenyl)-3-oxopropyl]ammonium IUPAC Name: (3-ethoxy-2-hydroxyphenyl)methyl-[(1R)-3-ethoxy-1-(4-methylphenyl)-3-oxopropyl]azanium Traditional Name: (3-ethoxy-2-hydroxy-benzyl)-[(1R)-3-ethoxy-3-keto-1-(p-tolyl)propyl]ammonium Formula: C21H28NO4+ MolecularWeight: 358.45132

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC(=C1O)C[NH2+]C(CC(=O)OCC)C2=CC=C(C=C2)C

Isomeric SMILES

CCOC1=CC=CC(=C1O)C[NH2+][C@H](CC(=O)OCC)C2=CC=C(C=C2)C

InChI

InChI=1S/C21H27NO4/c1-4-25-19-8-6-7-17(21(19)24)14-22-18(13-20(23)26-5-2)16-11-9-15(3)10-12-16/h6-12,18,22,24H,4-5,13-14H2,1-3H3/p+1/t18-/m1/s1