[(3S)-3-(2,5-dimethoxyphenyl)-3-phenoxy-propyl]azanium

Systemtic Name: [(3S)-3-(2,5-dimethoxyphenyl)-3-phenoxy-propyl]azanium Openeye Name: [(3S)-3-(2,5-dimethoxyphenyl)-3-phenoxy-propyl]ammonium CAS Name: [(3S)-3-(2,5-dimethoxyphenyl)-3-phenoxypropyl]ammonium IUPAC Name: [(3S)-3-(2,5-dimethoxyphenyl)-3-phenoxypropyl]azanium Traditional Name: [(3S)-3-(2,5-dimethoxyphenyl)-3-phenoxy-propyl]ammonium Formula: C17H22NO3+ MolecularWeight: 288.36148

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)OC)C(CC[NH3+])OC2=CC=CC=C2

Isomeric SMILES

COC1=CC(=C(C=C1)OC)[C@H](CC[NH3+])OC2=CC=CC=C2

InChI

InChI=1S/C17H21NO3/c1-19-14-8-9-16(20-2)15(12-14)17(10-11-18)21-13-6-4-3-5-7-13/h3-9,12,17H,10-11,18H2,1-2H3/p+1/t17-/m0/s1