(4-ethoxy-3-methoxy-phenyl)methyl-methyl-[2-oxidanylidene-2-[[(1R)-1-phenylethyl]amino]ethyl]azanium

Systemtic Name: (4-ethoxy-3-methoxy-phenyl)methyl-methyl-[2-oxidanylidene-2-[[(1R)-1-phenylethyl]amino]ethyl]azanium Openeye Name: (4-ethoxy-3-methoxy-phenyl)methyl-methyl-[2-oxo-2-[[(1R)-1-phenylethyl]amino]ethyl]ammonium CAS Name: (4-ethoxy-3-methoxyphenyl)methyl-methyl-[2-oxo-2-[[(1R)-1-phenylethyl]amino]ethyl]ammonium IUPAC Name: (4-ethoxy-3-methoxyphenyl)methyl-methyl-[2-oxo-2-[[(1R)-1-phenylethyl]amino]ethyl]azanium Traditional Name: (4-ethoxy-3-methoxy-benzyl)-[2-keto-2-[[(1R)-1-phenylethyl]amino]ethyl]-methyl-ammonium Formula: C21H29N2O3+ MolecularWeight: 357.46656

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)C[NH+](C)CC(=O)NC(C)C2=CC=CC=C2)OC

Isomeric SMILES

CCOC1=C(C=C(C=C1)C[NH+](C)CC(=O)N[C@H](C)C2=CC=CC=C2)OC

InChI

InChI=1S/C21H28N2O3/c1-5-26-19-12-11-17(13-20(19)25-4)14-23(3)15-21(24)22-16(2)18-9-7-6-8-10-18/h6-13,16H,5,14-15H2,1-4H3,(H,22,24)/p+1/t16-/m1/s1